NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
606666 |
5krw   |
30134 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5krw
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 221
_TA_constraint_stats_list.Viol_count 289
_TA_constraint_stats_list.Viol_total 8176.64
_TA_constraint_stats_list.Viol_max 4.63
_TA_constraint_stats_list.Viol_rms 0.44
_TA_constraint_stats_list.Viol_average_all_restraints 0.09
_TA_constraint_stats_list.Viol_average_violations_only 1.41
_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 3 SER C 1 4 THR N 1 4 THR CA 1 4 THR C -80.20 -40.20 -74.77 -81.00 -69.36 0.80 13 0 "[ . 1 . 2]"
2 . 1 4 THR N 1 4 THR CA 1 4 THR C 1 5 VAL N -56.10 -16.10 -38.85 -42.21 -43.54 . . 0 "[ . 1 . 2]"
3 . 1 4 THR C 1 5 VAL N 1 5 VAL CA 1 5 VAL C -81.70 -41.70 -73.23 -79.53 -68.91 . . 0 "[ . 1 . 2]"
4 . 1 5 VAL N 1 5 VAL CA 1 5 VAL C 1 6 GLU N -62.50 -22.50 -39.24 -41.32 -42.02 . . 0 "[ . 1 . 2]"
5 . 1 5 VAL C 1 6 GLU N 1 6 GLU CA 1 6 GLU C -85.60 -45.60 -67.04 -66.75 -66.85 . . 0 "[ . 1 . 2]"
6 . 1 6 GLU N 1 6 GLU CA 1 6 GLU C 1 7 PHE N -59.40 -19.40 -35.77 -40.58 -31.22 . . 0 "[ . 1 . 2]"
7 . 1 6 GLU C 1 7 PHE N 1 7 PHE CA 1 7 PHE C -83.70 -43.70 -54.18 -59.25 -50.02 . . 0 "[ . 1 . 2]"
8 . 1 7 PHE N 1 7 PHE CA 1 7 PHE C 1 8 ILE N -65.90 -25.90 -54.67 -61.37 -44.35 . . 0 "[ . 1 . 2]"
9 . 1 7 PHE C 1 8 ILE N 1 8 ILE CA 1 8 ILE C -83.60 -43.60 -56.59 -56.03 -56.61 . . 0 "[ . 1 . 2]"
10 . 1 8 ILE N 1 8 ILE CA 1 8 ILE C 1 9 ASN N -62.20 -22.20 -57.94 -62.52 -52.29 0.32 5 0 "[ . 1 . 2]"
11 . 1 8 ILE C 1 9 ASN N 1 9 ASN CA 1 9 ASN C -84.90 -44.90 -59.41 -65.94 -52.93 . . 0 "[ . 1 . 2]"
12 . 1 9 ASN N 1 9 ASN CA 1 9 ASN C 1 10 ARG N -59.90 -19.90 -45.65 -53.45 -36.74 . . 0 "[ . 1 . 2]"
13 . 1 9 ASN C 1 10 ARG N 1 10 ARG CA 1 10 ARG C -84.50 -44.50 -73.16 -70.48 -71.73 . . 0 "[ . 1 . 2]"
14 . 1 10 ARG N 1 10 ARG CA 1 10 ARG C 1 11 TRP N -61.00 -21.00 -35.57 -37.97 -39.37 . . 0 "[ . 1 . 2]"
15 . 1 10 ARG C 1 11 TRP N 1 11 TRP CA 1 11 TRP C -86.70 -46.70 -63.51 -58.59 -60.72 . . 0 "[ . 1 . 2]"
16 . 1 11 TRP N 1 11 TRP CA 1 11 TRP C 1 12 GLN N -61.70 -21.70 -38.50 -42.64 -34.55 . . 0 "[ . 1 . 2]"
17 . 1 11 TRP C 1 12 GLN N 1 12 GLN CA 1 12 GLN C -84.80 -44.80 -58.87 -62.81 -53.58 . . 0 "[ . 1 . 2]"
18 . 1 12 GLN N 1 12 GLN CA 1 12 GLN C 1 13 ARG N -60.30 -20.30 -44.72 -45.40 -46.13 . . 0 "[ . 1 . 2]"
19 . 1 12 GLN C 1 13 ARG N 1 13 ARG CA 1 13 ARG C -83.50 -43.50 -61.08 -66.87 -57.84 . . 0 "[ . 1 . 2]"
20 . 1 13 ARG N 1 13 ARG CA 1 13 ARG C 1 14 ILE N -58.20 -18.20 -45.94 -45.61 -48.55 . . 0 "[ . 1 . 2]"
21 . 1 13 ARG C 1 14 ILE N 1 14 ILE CA 1 14 ILE C -85.20 -45.20 -57.40 -64.08 -52.05 . . 0 "[ . 1 . 2]"
22 . 1 14 ILE N 1 14 ILE CA 1 14 ILE C 1 15 ALA N -58.80 -18.80 -43.84 -44.69 -45.46 . . 0 "[ . 1 . 2]"
23 . 1 17 LEU C 1 18 SER N 1 18 SER CA 1 18 SER C -83.70 -43.70 -56.20 -53.73 -54.55 . . 0 "[ . 1 . 2]"
24 . 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 GLN N -58.40 -18.40 -44.11 -44.26 -44.64 . . 0 "[ . 1 . 2]"
25 . 1 18 SER C 1 19 GLN N 1 19 GLN CA 1 19 GLN C -84.00 -44.00 -61.33 -64.98 -56.10 . . 0 "[ . 1 . 2]"
26 . 1 19 GLN N 1 19 GLN CA 1 19 GLN C 1 20 SER N -57.50 -17.50 -49.10 -51.25 -51.67 . . 0 "[ . 1 . 2]"
27 . 1 19 GLN C 1 20 SER N 1 20 SER CA 1 20 SER C -85.90 -45.90 -61.64 -65.80 -73.38 . . 0 "[ . 1 . 2]"
28 . 1 20 SER N 1 20 SER CA 1 20 SER C 1 21 LEU N -58.80 -18.80 -53.02 -60.31 -38.79 1.51 5 0 "[ . 1 . 2]"
29 . 1 20 SER C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -85.30 -45.30 -72.08 -79.86 -66.24 . . 0 "[ . 1 . 2]"
30 . 1 21 LEU N 1 21 LEU CA 1 21 LEU C 1 22 LEU N -61.20 -21.20 -22.17 -26.50 -19.02 2.18 11 0 "[ . 1 . 2]"
31 . 1 21 LEU C 1 22 LEU N 1 22 LEU CA 1 22 LEU C -86.10 -46.10 -63.69 -64.86 -65.91 . . 0 "[ . 1 . 2]"
32 . 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 GLU N -60.50 -20.50 -47.94 -55.98 -41.75 . . 0 "[ . 1 . 2]"
33 . 1 22 LEU C 1 23 GLU N 1 23 GLU CA 1 23 GLU C -84.40 -44.40 -60.85 -66.61 -54.78 . . 0 "[ . 1 . 2]"
34 . 1 23 GLU N 1 23 GLU CA 1 23 GLU C 1 24 LEU N -59.90 -19.90 -39.74 -47.99 -24.63 . . 0 "[ . 1 . 2]"
35 . 1 23 GLU C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -84.30 -44.30 -67.16 -65.89 -66.89 . . 0 "[ . 1 . 2]"
36 . 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 ALA N -61.90 -21.90 -37.29 -35.53 -37.53 . . 0 "[ . 1 . 2]"
37 . 1 24 LEU C 1 25 ALA N 1 25 ALA CA 1 25 ALA C -85.00 -45.00 -68.10 -73.67 -61.31 . . 0 "[ . 1 . 2]"
38 . 1 25 ALA N 1 25 ALA CA 1 25 ALA C 1 26 GLN N -59.50 -19.50 -43.87 -49.83 -34.91 . . 0 "[ . 1 . 2]"
39 . 1 25 ALA C 1 26 GLN N 1 26 GLN CA 1 26 GLN C -85.30 -45.30 -72.84 -79.99 -65.35 . . 0 "[ . 1 . 2]"
40 . 1 26 GLN N 1 26 GLN CA 1 26 GLN C 1 27 ARG N -48.30 -8.30 -26.73 -22.74 -25.45 . . 0 "[ . 1 . 2]"
41 . 1 26 GLN C 1 27 ARG N 1 27 ARG CA 1 27 ARG C -106.50 -66.50 -76.93 -85.81 -68.88 . . 0 "[ . 1 . 2]"
42 . 1 27 ARG N 1 27 ARG CA 1 27 ARG C 1 28 GLY N -25.40 14.60 -21.52 -26.61 -8.51 1.21 8 0 "[ . 1 . 2]"
43 . 1 27 ARG C 1 28 GLY N 1 28 GLY CA 1 28 GLY C 61.50 101.50 92.92 87.66 85.91 2.13 5 0 "[ . 1 . 2]"
44 . 1 28 GLY N 1 28 GLY CA 1 28 GLY C 1 29 GLU N -5.10 34.90 4.58 -5.80 12.84 0.70 20 0 "[ . 1 . 2]"
45 . 1 28 GLY C 1 29 GLU N 1 29 GLU CA 1 29 GLU C -108.20 -68.20 -75.55 -86.07 -68.54 . . 0 "[ . 1 . 2]"
46 . 1 29 GLU N 1 29 GLU CA 1 29 GLU C 1 30 TRP N 51.30 91.30 84.63 75.06 92.05 0.75 5 0 "[ . 1 . 2]"
47 . 1 29 GLU C 1 30 TRP N 1 30 TRP CA 1 30 TRP C -89.90 -49.90 -72.05 -70.51 -71.62 . . 0 "[ . 1 . 2]"
48 . 1 30 TRP N 1 30 TRP CA 1 30 TRP C 1 31 ASP N -53.90 -13.90 -35.75 -37.80 -38.81 . . 0 "[ . 1 . 2]"
49 . 1 30 TRP C 1 31 ASP N 1 31 ASP CA 1 31 ASP C -81.60 -41.60 -59.19 -68.22 -53.44 . . 0 "[ . 1 . 2]"
50 . 1 31 ASP N 1 31 ASP CA 1 31 ASP C 1 32 LEU N -63.10 -23.10 -46.50 -50.48 -51.26 . . 0 "[ . 1 . 2]"
51 . 1 31 ASP C 1 32 LEU N 1 32 LEU CA 1 32 LEU C -88.10 -48.10 -73.16 -80.61 -67.76 . . 0 "[ . 1 . 2]"
52 . 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 33 LEU N -58.90 -18.90 -35.80 -36.17 -38.11 . . 0 "[ . 1 . 2]"
53 . 1 32 LEU C 1 33 LEU N 1 33 LEU CA 1 33 LEU C -83.70 -43.70 -57.76 -61.24 -54.22 . . 0 "[ . 1 . 2]"
54 . 1 33 LEU N 1 33 LEU CA 1 33 LEU C 1 34 LEU N -63.80 -23.80 -48.10 -58.73 -37.78 . . 0 "[ . 1 . 2]"
55 . 1 33 LEU C 1 34 LEU N 1 34 LEU CA 1 34 LEU C -85.10 -45.10 -75.08 -76.50 -77.19 . . 0 "[ . 1 . 2]"
56 . 1 34 LEU N 1 34 LEU CA 1 34 LEU C 1 35 GLN N -59.10 -19.10 -25.76 -25.17 -25.84 0.39 12 0 "[ . 1 . 2]"
57 . 1 34 LEU C 1 35 GLN N 1 35 GLN CA 1 35 GLN C -86.80 -46.80 -65.22 -72.46 -58.49 . . 0 "[ . 1 . 2]"
58 . 1 35 GLN N 1 35 GLN CA 1 35 GLN C 1 36 GLN N -57.90 -17.90 -40.07 -45.34 -33.65 . . 0 "[ . 1 . 2]"
59 . 1 35 GLN C 1 36 GLN N 1 36 GLN CA 1 36 GLN C -88.10 -48.10 -84.70 -89.07 -79.97 0.97 13 0 "[ . 1 . 2]"
60 . 1 36 GLN N 1 36 GLN CA 1 36 GLN C 1 37 GLU N -66.70 -6.70 -20.98 -19.43 -21.58 . . 0 "[ . 1 . 2]"
61 . 1 36 GLN C 1 37 GLU N 1 37 GLU CA 1 37 GLU C -94.60 -34.60 -50.66 -57.56 -44.09 . . 0 "[ . 1 . 2]"
62 . 1 37 GLU N 1 37 GLU CA 1 37 GLU C 1 38 VAL N -72.00 -12.00 -56.74 -62.12 -48.93 . . 0 "[ . 1 . 2]"
63 . 1 37 GLU C 1 38 VAL N 1 38 VAL CA 1 38 VAL C -92.70 -32.70 -58.86 -62.73 -55.82 . . 0 "[ . 1 . 2]"
64 . 1 38 VAL N 1 38 VAL CA 1 38 VAL C 1 39 SER N -63.80 -23.80 -44.68 -39.34 -41.27 . . 0 "[ . 1 . 2]"
65 . 1 38 VAL C 1 39 SER N 1 39 SER CA 1 39 SER C -85.60 -45.60 -66.58 -64.19 -65.74 . . 0 "[ . 1 . 2]"
66 . 1 39 SER N 1 39 SER CA 1 39 SER C 1 40 TYR N -58.00 -18.00 -44.17 -53.67 -35.45 . . 0 "[ . 1 . 2]"
67 . 1 39 SER C 1 40 TYR N 1 40 TYR CA 1 40 TYR C -83.20 -43.20 -65.23 -67.96 -68.31 . . 0 "[ . 1 . 2]"
68 . 1 40 TYR N 1 40 TYR CA 1 40 TYR C 1 41 LEU N -65.10 -25.10 -60.27 -57.96 -58.74 . . 0 "[ . 1 . 2]"
69 . 1 40 TYR C 1 41 LEU N 1 41 LEU CA 1 41 LEU C -86.70 -46.70 -61.73 -64.98 -58.38 . . 0 "[ . 1 . 2]"
70 . 1 41 LEU N 1 41 LEU CA 1 41 LEU C 1 42 GLN N -58.20 -18.20 -39.55 -40.90 -41.29 . . 0 "[ . 1 . 2]"
71 . 1 41 LEU C 1 42 GLN N 1 42 GLN CA 1 42 GLN C -85.50 -45.50 -60.01 -63.54 -63.79 . . 0 "[ . 1 . 2]"
72 . 1 42 GLN N 1 42 GLN CA 1 42 GLN C 1 43 SER N -60.20 -20.20 -42.25 -48.30 -34.45 . . 0 "[ . 1 . 2]"
73 . 1 42 GLN C 1 43 SER N 1 43 SER CA 1 43 SER C -86.30 -46.30 -62.35 -61.28 -61.94 . . 0 "[ . 1 . 2]"
74 . 1 43 SER N 1 43 SER CA 1 43 SER C 1 44 ILE N -60.80 -20.80 -39.98 -41.09 -41.91 . . 0 "[ . 1 . 2]"
75 . 1 43 SER C 1 44 ILE N 1 44 ILE CA 1 44 ILE C -86.60 -46.60 -64.37 -60.86 -62.70 . . 0 "[ . 1 . 2]"
76 . 1 44 ILE N 1 44 ILE CA 1 44 ILE C 1 45 GLU N -61.10 -21.10 -46.56 -60.92 -38.24 . . 0 "[ . 1 . 2]"
77 . 1 44 ILE C 1 45 GLU N 1 45 GLU CA 1 45 GLU C -82.40 -42.40 -63.84 -57.93 -58.99 . . 0 "[ . 1 . 2]"
78 . 1 45 GLU N 1 45 GLU CA 1 45 GLU C 1 46 THR N -61.00 -21.00 -38.00 -43.67 -46.19 . . 0 "[ . 1 . 2]"
79 . 1 45 GLU C 1 46 THR N 1 46 THR CA 1 46 THR C -83.50 -43.50 -79.89 -86.88 -71.95 3.38 19 0 "[ . 1 . 2]"
80 . 1 46 THR N 1 46 THR CA 1 46 THR C 1 47 VAL N -63.10 -23.10 -29.39 -23.78 -24.67 0.11 2 0 "[ . 1 . 2]"
81 . 1 46 THR C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -86.90 -46.90 -72.40 -78.38 -67.01 . . 0 "[ . 1 . 2]"
82 . 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 MET N -56.30 -16.30 -31.37 -30.03 -31.27 . . 0 "[ . 1 . 2]"
83 . 1 47 VAL C 1 48 MET N 1 48 MET CA 1 48 MET C -97.70 -37.70 -83.33 -86.10 -87.15 1.05 13 0 "[ . 1 . 2]"
84 . 1 48 MET N 1 48 MET CA 1 48 MET C 1 49 GLU N -60.80 -0.80 -17.64 -20.34 -21.31 0.87 20 0 "[ . 1 . 2]"
85 . 1 48 MET C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -107.50 -67.50 -71.51 -73.27 -77.21 1.90 15 0 "[ . 1 . 2]"
86 . 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 LYS N -30.10 9.90 -30.50 -24.55 -28.01 4.33 16 0 "[ . 1 . 2]"
87 . 1 56 ILE C 1 57 THR N 1 57 THR CA 1 57 THR C -150.70 -75.90 -76.39 -75.58 -75.74 1.63 9 0 "[ . 1 . 2]"
88 . 1 57 THR N 1 57 THR CA 1 57 THR C 1 58 ARG N 113.40 175.10 170.71 164.65 175.95 0.85 13 0 "[ . 1 . 2]"
89 . 1 57 THR C 1 58 ARG N 1 58 ARG CA 1 58 ARG C -100.50 -70.50 -67.14 -68.26 -65.87 4.63 18 0 "[ . 1 . 2]"
90 . 1 58 ARG N 1 58 ARG CA 1 58 ARG C 1 59 SER N -140.20 165.20 -26.74 -30.02 -32.48 . . 0 "[ . 1 . 2]"
91 . 1 58 ARG C 1 59 SER N 1 59 SER CA 1 59 SER C -81.90 -70.90 -71.38 -70.52 -70.68 1.39 15 0 "[ . 1 . 2]"
92 . 1 59 SER N 1 59 SER CA 1 59 SER C 1 60 ILE N -56.80 -16.80 -47.79 -46.67 -47.01 0.07 4 0 "[ . 1 . 2]"
93 . 1 59 SER C 1 60 ILE N 1 60 ILE CA 1 60 ILE C -86.40 -46.40 -66.69 -67.91 -68.90 . . 0 "[ . 1 . 2]"
94 . 1 60 ILE N 1 60 ILE CA 1 60 ILE C 1 61 GLN N -63.40 -23.40 -40.45 -45.19 -35.64 . . 0 "[ . 1 . 2]"
95 . 1 60 ILE C 1 61 GLN N 1 61 GLN CA 1 61 GLN C -81.50 -41.50 -58.97 -63.14 -65.47 . . 0 "[ . 1 . 2]"
96 . 1 61 GLN N 1 61 GLN CA 1 61 GLN C 1 62 ASP N -62.60 -22.60 -41.75 -38.86 -39.95 . . 0 "[ . 1 . 2]"
97 . 1 61 GLN C 1 62 ASP N 1 62 ASP CA 1 62 ASP C -85.10 -45.10 -65.42 -72.20 -59.66 . . 0 "[ . 1 . 2]"
98 . 1 62 ASP N 1 62 ASP CA 1 62 ASP C 1 63 MET N -59.00 -19.00 -45.74 -51.27 -35.35 . . 0 "[ . 1 . 2]"
99 . 1 62 ASP C 1 63 MET N 1 63 MET CA 1 63 MET C -84.70 -44.70 -58.24 -58.80 -59.67 . . 0 "[ . 1 . 2]"
100 . 1 63 MET N 1 63 MET CA 1 63 MET C 1 64 VAL N -65.40 -25.40 -56.95 -53.66 -54.37 0.45 18 0 "[ . 1 . 2]"
101 . 1 63 MET C 1 64 VAL N 1 64 VAL CA 1 64 VAL C -83.80 -43.80 -70.18 -71.99 -73.15 . . 0 "[ . 1 . 2]"
102 . 1 64 VAL N 1 64 VAL CA 1 64 VAL C 1 65 ALA N -63.60 -23.60 -28.77 -40.60 -21.40 2.20 18 0 "[ . 1 . 2]"
103 . 1 64 VAL C 1 65 ALA N 1 65 ALA CA 1 65 ALA C -82.10 -42.10 -63.28 -61.62 -62.55 . . 0 "[ . 1 . 2]"
104 . 1 65 ALA N 1 65 ALA CA 1 65 ALA C 1 66 GLY N -59.00 -19.00 -37.69 -39.94 -43.23 . . 0 "[ . 1 . 2]"
105 . 1 65 ALA C 1 66 GLY N 1 66 GLY CA 1 66 GLY C -84.80 -44.80 -63.63 -67.53 -58.90 . . 0 "[ . 1 . 2]"
106 . 1 66 GLY N 1 66 GLY CA 1 66 GLY C 1 67 TYR N -60.20 -20.20 -42.73 -47.34 -36.92 . . 0 "[ . 1 . 2]"
107 . 1 66 GLY C 1 67 TYR N 1 67 TYR CA 1 67 TYR C -85.50 -45.50 -66.37 -71.86 -60.20 . . 0 "[ . 1 . 2]"
108 . 1 67 TYR N 1 67 TYR CA 1 67 TYR C 1 68 ILE N -62.20 -22.20 -37.78 -39.60 -40.91 . . 0 "[ . 1 . 2]"
109 . 1 67 TYR C 1 68 ILE N 1 68 ILE CA 1 68 ILE C -84.30 -44.30 -71.31 -75.43 -67.54 . . 0 "[ . 1 . 2]"
110 . 1 68 ILE N 1 68 ILE CA 1 68 ILE C 1 69 LYS N -62.60 -22.60 -40.10 -39.90 -40.94 . . 0 "[ . 1 . 2]"
111 . 1 68 ILE C 1 69 LYS N 1 69 LYS CA 1 69 LYS C -83.90 -43.90 -59.67 -64.24 -54.84 . . 0 "[ . 1 . 2]"
112 . 1 69 LYS N 1 69 LYS CA 1 69 LYS C 1 70 GLN N -58.60 -18.60 -42.61 -41.96 -42.58 . . 0 "[ . 1 . 2]"
113 . 1 69 LYS C 1 70 GLN N 1 70 GLN CA 1 70 GLN C -85.00 -45.00 -62.69 -69.08 -58.44 . . 0 "[ . 1 . 2]"
114 . 1 70 GLN N 1 70 GLN CA 1 70 GLN C 1 71 THR N -59.40 -19.40 -50.80 -52.19 -52.93 . . 0 "[ . 1 . 2]"
115 . 1 70 GLN C 1 71 THR N 1 71 THR CA 1 71 THR C -85.30 -45.30 -66.75 -65.91 -66.80 . . 0 "[ . 1 . 2]"
116 . 1 71 THR N 1 71 THR CA 1 71 THR C 1 72 LEU N -64.10 -24.10 -32.46 -44.22 -26.91 . . 0 "[ . 1 . 2]"
117 . 1 71 THR C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -84.40 -44.40 -66.72 -65.92 -67.31 . . 0 "[ . 1 . 2]"
118 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 ASP N -64.30 -24.30 -45.01 -48.75 -39.63 . . 0 "[ . 1 . 2]"
119 . 1 72 LEU C 1 73 ASP N 1 73 ASP CA 1 73 ASP C -84.20 -44.20 -60.12 -65.71 -54.97 . . 0 "[ . 1 . 2]"
120 . 1 73 ASP N 1 73 ASP CA 1 73 ASP C 1 74 ASN N -60.20 -20.20 -53.39 -51.74 -52.24 . . 0 "[ . 1 . 2]"
121 . 1 73 ASP C 1 74 ASN N 1 74 ASN CA 1 74 ASN C -87.70 -47.70 -65.03 -68.71 -61.27 . . 0 "[ . 1 . 2]"
122 . 1 74 ASN N 1 74 ASN CA 1 74 ASN C 1 75 GLU N -57.60 -17.60 -42.36 -41.88 -42.26 . . 0 "[ . 1 . 2]"
123 . 1 74 ASN C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -83.20 -43.20 -74.44 -74.90 -75.66 . . 0 "[ . 1 . 2]"
124 . 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 GLN N -61.90 -21.90 -24.93 -28.02 -20.73 1.17 17 0 "[ . 1 . 2]"
125 . 1 75 GLU C 1 76 GLN N 1 76 GLN CA 1 76 GLN C -84.00 -44.00 -69.89 -70.22 -71.60 . . 0 "[ . 1 . 2]"
126 . 1 76 GLN N 1 76 GLN CA 1 76 GLN C 1 77 LEU N -61.10 -21.10 -40.81 -48.99 -34.73 . . 0 "[ . 1 . 2]"
127 . 1 76 GLN C 1 77 LEU N 1 77 LEU CA 1 77 LEU C -84.70 -44.70 -68.97 -69.33 -69.42 . . 0 "[ . 1 . 2]"
128 . 1 77 LEU N 1 77 LEU CA 1 77 LEU C 1 78 LEU N -63.20 -23.20 -32.35 -31.99 -32.48 . . 0 "[ . 1 . 2]"
129 . 1 77 LEU C 1 78 LEU N 1 78 LEU CA 1 78 LEU C -83.80 -43.80 -64.77 -64.03 -64.63 . . 0 "[ . 1 . 2]"
130 . 1 78 LEU N 1 78 LEU CA 1 78 LEU C 1 79 LYS N -61.90 -21.90 -44.50 -49.51 -37.58 . . 0 "[ . 1 . 2]"
131 . 1 78 LEU C 1 79 LYS N 1 79 LYS CA 1 79 LYS C -82.70 -42.70 -54.27 -53.81 -53.98 . . 0 "[ . 1 . 2]"
132 . 1 79 LYS N 1 79 LYS CA 1 79 LYS C 1 80 GLY N -60.70 -20.70 -53.11 -54.71 -56.04 . . 0 "[ . 1 . 2]"
133 . 1 79 LYS C 1 80 GLY N 1 80 GLY CA 1 80 GLY C -83.80 -43.80 -66.74 -73.01 -61.49 . . 0 "[ . 1 . 2]"
134 . 1 80 GLY N 1 80 GLY CA 1 80 GLY C 1 81 LEU N -62.80 -22.80 -49.70 -45.93 -46.47 . . 0 "[ . 1 . 2]"
135 . 1 80 GLY C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -85.90 -45.90 -61.76 -64.94 -56.83 . . 0 "[ . 1 . 2]"
136 . 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 LEU N -62.70 -22.70 -55.32 -59.90 -50.08 . . 0 "[ . 1 . 2]"
137 . 1 81 LEU C 1 82 LEU N 1 82 LEU CA 1 82 LEU C -84.00 -44.00 -66.65 -68.02 -69.06 . . 0 "[ . 1 . 2]"
138 . 1 82 LEU N 1 82 LEU CA 1 82 LEU C 1 83 GLN N -62.80 -22.80 -28.74 -36.01 -22.56 0.24 12 0 "[ . 1 . 2]"
139 . 1 82 LEU C 1 83 GLN N 1 83 GLN CA 1 83 GLN C -84.50 -44.50 -62.00 -58.89 -61.08 . . 0 "[ . 1 . 2]"
140 . 1 83 GLN N 1 83 GLN CA 1 83 GLN C 1 84 GLN N -57.00 -17.00 -43.15 -49.76 -37.02 . . 0 "[ . 1 . 2]"
141 . 1 83 GLN C 1 84 GLN N 1 84 GLN CA 1 84 GLN C -86.30 -46.30 -60.59 -64.28 -58.02 . . 0 "[ . 1 . 2]"
142 . 1 84 GLN N 1 84 GLN CA 1 84 GLN C 1 85 ARG N -59.60 -19.60 -48.52 -49.07 -49.34 . . 0 "[ . 1 . 2]"
143 . 1 84 GLN C 1 85 ARG N 1 85 ARG CA 1 85 ARG C -86.90 -46.90 -58.90 -62.68 -54.43 . . 0 "[ . 1 . 2]"
144 . 1 85 ARG N 1 85 ARG CA 1 85 ARG C 1 86 LEU N -59.90 -19.90 -48.43 -50.00 -50.76 . . 0 "[ . 1 . 2]"
145 . 1 85 ARG C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -84.00 -44.00 -66.68 -73.04 -61.87 . . 0 "[ . 1 . 2]"
146 . 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 ASP N -62.10 -22.10 -33.88 -39.20 -25.19 . . 0 "[ . 1 . 2]"
147 . 1 86 LEU C 1 87 ASP N 1 87 ASP CA 1 87 ASP C -84.10 -44.10 -64.66 -62.62 -63.97 . . 0 "[ . 1 . 2]"
148 . 1 87 ASP N 1 87 ASP CA 1 87 ASP C 1 88 GLU N -62.90 -22.90 -44.04 -43.57 -44.40 . . 0 "[ . 1 . 2]"
149 . 1 87 ASP C 1 88 GLU N 1 88 GLU CA 1 88 GLU C -84.30 -44.30 -66.51 -70.54 -60.69 . . 0 "[ . 1 . 2]"
150 . 1 88 GLU N 1 88 GLU CA 1 88 GLU C 1 89 LEU N -63.90 -23.90 -48.58 -48.29 -49.02 . . 0 "[ . 1 . 2]"
151 . 1 88 GLU C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -84.10 -44.10 -60.60 -64.71 -56.01 . . 0 "[ . 1 . 2]"
152 . 1 89 LEU N 1 89 LEU CA 1 89 LEU C 1 90 SER N -63.10 -23.10 -42.73 -52.28 -33.31 . . 0 "[ . 1 . 2]"
153 . 1 89 LEU C 1 90 SER N 1 90 SER CA 1 90 SER C -81.90 -41.90 -63.20 -62.28 -63.04 . . 0 "[ . 1 . 2]"
154 . 1 90 SER N 1 90 SER CA 1 90 SER C 1 91 SER N -59.50 -19.50 -40.16 -35.79 -37.61 . . 0 "[ . 1 . 2]"
155 . 1 90 SER C 1 91 SER N 1 91 SER CA 1 91 SER C -86.80 -46.80 -64.84 -65.43 -67.41 . . 0 "[ . 1 . 2]"
156 . 1 91 SER N 1 91 SER CA 1 91 SER C 1 92 LEU N -58.90 -18.90 -38.72 -46.77 -30.39 . . 0 "[ . 1 . 2]"
157 . 1 91 SER C 1 92 LEU N 1 92 LEU CA 1 92 LEU C -86.80 -46.80 -68.00 -70.52 -72.89 . . 0 "[ . 1 . 2]"
158 . 1 92 LEU N 1 92 LEU CA 1 92 LEU C 1 93 ILE N -63.50 -23.50 -45.68 -40.09 -41.06 . . 0 "[ . 1 . 2]"
159 . 1 92 LEU C 1 93 ILE N 1 93 ILE CA 1 93 ILE C -86.50 -46.50 -61.48 -60.79 -61.50 . . 0 "[ . 1 . 2]"
160 . 1 93 ILE N 1 93 ILE CA 1 93 ILE C 1 94 GLY N -52.30 -12.30 -41.14 -52.58 -34.65 0.28 9 0 "[ . 1 . 2]"
161 . 1 93 ILE C 1 94 GLY N 1 94 GLY CA 1 94 GLY C -91.00 -51.00 -62.15 -62.52 -63.37 . . 0 "[ . 1 . 2]"
162 . 1 94 GLY N 1 94 GLY CA 1 94 GLY C 1 95 GLN N -38.10 7.10 -27.59 -39.19 -13.98 1.09 15 0 "[ . 1 . 2]"
163 . 1 96 VAL C 1 97 LEU N 1 97 LEU CA 1 97 LEU C -98.40 -58.40 -85.15 -99.03 -72.47 0.63 17 0 "[ . 1 . 2]"
164 . 1 97 LEU N 1 97 LEU CA 1 97 LEU C 1 98 PHE N 113.40 153.40 113.23 113.28 112.38 2.83 11 0 "[ . 1 . 2]"
165 . 1 10 ARG N 1 10 ARG CA 1 10 ARG CB 1 10 ARG CG -70.00 -50.00 -63.62 -61.35 -62.21 . . 0 "[ . 1 . 2]"
166 . 1 10 ARG CA 1 10 ARG CB 1 10 ARG CG 1 10 ARG CD 170.00 -170.00 179.46 173.75 -173.40 . . 0 "[ . 1 . 2]"
167 . 1 35 GLN N 1 35 GLN CA 1 35 GLN CB 1 35 GLN CG 170.00 -170.00 -177.76 -173.17 -175.46 . . 0 "[ . 1 . 2]"
168 . 1 35 GLN CA 1 35 GLN CB 1 35 GLN CG 1 35 GLN CD 50.00 70.00 61.37 61.71 60.93 . . 0 "[ . 1 . 2]"
169 . 1 37 GLU N 1 37 GLU CA 1 37 GLU CB 1 37 GLU CG 170.00 -170.00 172.38 172.67 171.07 2.15 16 0 "[ . 1 . 2]"
170 . 1 37 GLU CA 1 37 GLU CB 1 37 GLU CG 1 37 GLU CD 170.00 -170.00 -168.15 -167.45 -167.81 3.31 5 0 "[ . 1 . 2]"
171 . 1 37 GLU CA 1 37 GLU CB 1 37 GLU CG 1 37 GLU CD 170.00 -170.00 -168.15 -167.45 -167.81 3.31 5 0 "[ . 1 . 2]"
172 . 1 75 GLU N 1 75 GLU CA 1 75 GLU CB 1 75 GLU CG 170.00 -170.00 -176.71 178.20 -173.33 . . 0 "[ . 1 . 2]"
173 . 1 75 GLU CA 1 75 GLU CB 1 75 GLU CG 1 75 GLU CD 170.00 -170.00 168.86 167.89 167.74 2.90 15 0 "[ . 1 . 2]"
174 . 1 76 GLN N 1 76 GLN CA 1 76 GLN CB 1 76 GLN CG 170.00 -170.00 179.35 178.44 178.27 . . 0 "[ . 1 . 2]"
175 . 1 76 GLN CA 1 76 GLN CB 1 76 GLN CG 1 76 GLN CD 170.00 -170.00 -177.43 -174.87 -177.15 . . 0 "[ . 1 . 2]"
176 . 1 30 TRP N 1 30 TRP CA 1 30 TRP CB 1 30 TRP CG -53.00 -33.00 -51.57 -52.03 -52.62 0.60 9 0 "[ . 1 . 2]"
177 . 1 7 PHE N 1 7 PHE CA 1 7 PHE CB 1 7 PHE CG 170.00 -170.00 173.44 174.00 172.98 0.87 15 0 "[ . 1 . 2]"
178 . 1 63 MET N 1 63 MET CA 1 63 MET CB 1 63 MET CG -70.00 -50.00 -62.23 -61.95 -62.69 0.29 14 0 "[ . 1 . 2]"
179 . 1 63 MET CA 1 63 MET CB 1 63 MET CG 1 63 MET SD 170.00 -170.00 -173.23 165.38 -168.23 4.62 14 0 "[ . 1 . 2]"
180 . 1 44 ILE N 1 44 ILE CA 1 44 ILE CB 1 44 ILE CG1 -70.00 -50.00 -56.02 -61.49 -51.30 . . 0 "[ . 1 . 2]"
181 . 1 44 ILE CA 1 44 ILE CB 1 44 ILE CG1 1 44 ILE CD1 170.00 -170.00 175.64 -179.96 176.55 . . 0 "[ . 1 . 2]"
182 . 1 68 ILE N 1 68 ILE CA 1 68 ILE CB 1 68 ILE CG1 -70.00 -50.00 -55.05 -52.75 -53.91 0.74 18 0 "[ . 1 . 2]"
183 . 1 68 ILE CA 1 68 ILE CB 1 68 ILE CG1 1 68 ILE CD1 170.00 -170.00 173.32 170.04 176.27 . . 0 "[ . 1 . 2]"
184 . 1 60 ILE N 1 60 ILE CA 1 60 ILE CB 1 60 ILE CG1 -70.00 -50.00 -61.75 -65.38 -58.69 . . 0 "[ . 1 . 2]"
185 . 1 60 ILE CA 1 60 ILE CB 1 60 ILE CG1 1 60 ILE CD1 170.00 -170.00 174.14 171.13 178.90 . . 0 "[ . 1 . 2]"
186 . 1 8 ILE N 1 8 ILE CA 1 8 ILE CB 1 8 ILE CG1 -70.00 -50.00 -60.55 -65.01 -55.85 . . 0 "[ . 1 . 2]"
187 . 1 8 ILE CA 1 8 ILE CB 1 8 ILE CG1 1 8 ILE CD1 170.00 -170.00 170.92 169.29 172.97 0.71 11 0 "[ . 1 . 2]"
188 . 1 14 ILE N 1 14 ILE CA 1 14 ILE CB 1 14 ILE CG1 -70.00 -50.00 -64.87 -69.31 -59.35 . . 0 "[ . 1 . 2]"
189 . 1 14 ILE CA 1 14 ILE CB 1 14 ILE CG1 1 14 ILE CD1 170.00 -170.00 171.45 169.12 177.53 0.88 10 0 "[ . 1 . 2]"
190 . 1 93 ILE N 1 93 ILE CA 1 93 ILE CB 1 93 ILE CG1 -70.00 -50.00 -60.96 -63.17 -63.44 . . 0 "[ . 1 . 2]"
191 . 1 93 ILE CA 1 93 ILE CB 1 93 ILE CG1 1 93 ILE CD1 170.00 -170.00 171.36 173.53 173.22 1.30 8 0 "[ . 1 . 2]"
192 . 1 16 LEU N 1 16 LEU CA 1 16 LEU CB 1 16 LEU CG -70.00 -50.00 -63.88 -71.12 -57.47 1.12 15 0 "[ . 1 . 2]"
193 . 1 16 LEU CA 1 16 LEU CB 1 16 LEU CG 1 16 LEU CD1 170.00 -170.00 175.92 169.10 -178.57 0.90 15 0 "[ . 1 . 2]"
194 . 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG -70.00 -50.00 -67.77 -71.70 -62.35 1.70 13 0 "[ . 1 . 2]"
195 . 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 1 17 LEU CD1 170.00 -170.00 174.12 169.89 179.19 0.11 2 0 "[ . 1 . 2]"
196 . 1 22 LEU N 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 170.00 -170.00 177.41 173.31 -179.43 . . 0 "[ . 1 . 2]"
197 . 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 1 22 LEU CD1 50.00 70.00 63.90 61.65 66.83 . . 0 "[ . 1 . 2]"
198 . 1 24 LEU N 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG -70.00 -50.00 -59.80 -65.65 -54.56 . . 0 "[ . 1 . 2]"
199 . 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG 1 24 LEU CD1 170.00 -170.00 170.88 171.33 171.10 1.26 8 0 "[ . 1 . 2]"
200 . 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG -70.00 -50.00 -60.97 -56.47 -57.17 . . 0 "[ . 1 . 2]"
201 . 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 1 32 LEU CD1 170.00 -170.00 -179.42 -179.73 179.38 . . 0 "[ . 1 . 2]"
202 . 1 34 LEU N 1 34 LEU CA 1 34 LEU CB 1 34 LEU CG -70.00 -50.00 -61.59 -59.63 -60.17 . . 0 "[ . 1 . 2]"
203 . 1 34 LEU CA 1 34 LEU CB 1 34 LEU CG 1 34 LEU CD1 170.00 -170.00 170.42 168.93 174.62 1.07 16 0 "[ . 1 . 2]"
204 . 1 41 LEU N 1 41 LEU CA 1 41 LEU CB 1 41 LEU CG -70.00 -50.00 -63.45 -67.88 -60.69 . . 0 "[ . 1 . 2]"
205 . 1 41 LEU CA 1 41 LEU CB 1 41 LEU CG 1 41 LEU CD1 170.00 -170.00 175.41 176.99 176.68 . . 0 "[ . 1 . 2]"
206 . 1 72 LEU N 1 72 LEU CA 1 72 LEU CB 1 72 LEU CG -70.00 -50.00 -70.97 -70.69 -70.79 2.76 5 0 "[ . 1 . 2]"
207 . 1 72 LEU CA 1 72 LEU CB 1 72 LEU CG 1 72 LEU CD1 170.00 -170.00 173.11 173.63 173.39 . . 0 "[ . 1 . 2]"
208 . 1 77 LEU N 1 77 LEU CA 1 77 LEU CB 1 77 LEU CG -70.00 -50.00 -61.34 -67.06 -56.36 . . 0 "[ . 1 . 2]"
209 . 1 77 LEU CA 1 77 LEU CB 1 77 LEU CG 1 77 LEU CD1 170.00 -170.00 177.81 179.26 178.60 . . 0 "[ . 1 . 2]"
210 . 1 78 LEU N 1 78 LEU CA 1 78 LEU CB 1 78 LEU CG -70.00 -50.00 -64.56 -68.45 -60.13 . . 0 "[ . 1 . 2]"
211 . 1 78 LEU CA 1 78 LEU CB 1 78 LEU CG 1 78 LEU CD1 170.00 -170.00 172.17 170.15 173.92 . . 0 "[ . 1 . 2]"
212 . 1 81 LEU N 1 81 LEU CA 1 81 LEU CB 1 81 LEU CG 165.00 -165.00 -167.09 -166.70 -166.80 0.98 14 0 "[ . 1 . 2]"
213 . 1 81 LEU CA 1 81 LEU CB 1 81 LEU CG 1 81 LEU CD1 165.00 -165.00 163.19 162.79 162.58 3.17 12 0 "[ . 1 . 2]"
214 . 1 82 LEU N 1 82 LEU CA 1 82 LEU CB 1 82 LEU CG -70.00 -50.00 -56.55 -58.08 -58.46 . . 0 "[ . 1 . 2]"
215 . 1 82 LEU CA 1 82 LEU CB 1 82 LEU CG 1 82 LEU CD1 170.00 -170.00 -179.49 -179.22 -179.41 . . 0 "[ . 1 . 2]"
216 . 1 89 LEU N 1 89 LEU CA 1 89 LEU CB 1 89 LEU CG -70.00 -50.00 -63.75 -61.69 -62.72 . . 0 "[ . 1 . 2]"
217 . 1 89 LEU CA 1 89 LEU CB 1 89 LEU CG 1 89 LEU CD1 170.00 -170.00 176.88 177.91 177.38 . . 0 "[ . 1 . 2]"
218 . 1 92 LEU N 1 92 LEU CA 1 92 LEU CB 1 92 LEU CG -70.00 -50.00 -62.69 -59.37 -61.04 . . 0 "[ . 1 . 2]"
219 . 1 92 LEU CA 1 92 LEU CB 1 92 LEU CG 1 92 LEU CD1 170.00 -170.00 176.34 172.92 -173.86 . . 0 "[ . 1 . 2]"
220 . 1 86 LEU N 1 86 LEU CA 1 86 LEU CB 1 86 LEU CG -70.00 -50.00 -66.93 -67.31 -67.39 . . 0 "[ . 1 . 2]"
221 . 1 86 LEU CA 1 86 LEU CB 1 86 LEU CG 1 86 LEU CD1 170.00 -170.00 177.93 -176.85 -177.89 . . 0 "[ . 1 . 2]"
stop_
save_
save_dihedral_constraint_statistics_2
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 221
_TA_constraint_stats_list.Viol_count 289
_TA_constraint_stats_list.Viol_total 8176.64
_TA_constraint_stats_list.Viol_max 4.63
_TA_constraint_stats_list.Viol_rms 0.44
_TA_constraint_stats_list.Viol_average_all_restraints 0.09
_TA_constraint_stats_list.Viol_average_violations_only 1.41
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details .
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 3 SER C 1 4 THR N 1 4 THR CA 1 4 THR C -80.20 -40.20 -74.77 -81.00 -69.36 0.80 13 0 "[ . 1 . 2]"
2 . 1 4 THR N 1 4 THR CA 1 4 THR C 1 5 VAL N -56.10 -16.10 -38.85 -42.21 -43.54 . . 0 "[ . 1 . 2]"
3 . 1 4 THR C 1 5 VAL N 1 5 VAL CA 1 5 VAL C -81.70 -41.70 -73.23 -79.53 -68.91 . . 0 "[ . 1 . 2]"
4 . 1 5 VAL N 1 5 VAL CA 1 5 VAL C 1 6 GLU N -62.50 -22.50 -39.24 -41.32 -42.02 . . 0 "[ . 1 . 2]"
5 . 1 5 VAL C 1 6 GLU N 1 6 GLU CA 1 6 GLU C -85.60 -45.60 -67.04 -66.75 -66.85 . . 0 "[ . 1 . 2]"
6 . 1 6 GLU N 1 6 GLU CA 1 6 GLU C 1 7 PHE N -59.40 -19.40 -35.77 -40.58 -31.22 . . 0 "[ . 1 . 2]"
7 . 1 6 GLU C 1 7 PHE N 1 7 PHE CA 1 7 PHE C -83.70 -43.70 -54.18 -59.25 -50.02 . . 0 "[ . 1 . 2]"
8 . 1 7 PHE N 1 7 PHE CA 1 7 PHE C 1 8 ILE N -65.90 -25.90 -54.67 -61.37 -44.35 . . 0 "[ . 1 . 2]"
9 . 1 7 PHE C 1 8 ILE N 1 8 ILE CA 1 8 ILE C -83.60 -43.60 -56.59 -56.03 -56.61 . . 0 "[ . 1 . 2]"
10 . 1 8 ILE N 1 8 ILE CA 1 8 ILE C 1 9 ASN N -62.20 -22.20 -57.94 -62.52 -52.29 0.32 5 0 "[ . 1 . 2]"
11 . 1 8 ILE C 1 9 ASN N 1 9 ASN CA 1 9 ASN C -84.90 -44.90 -59.41 -65.94 -52.93 . . 0 "[ . 1 . 2]"
12 . 1 9 ASN N 1 9 ASN CA 1 9 ASN C 1 10 ARG N -59.90 -19.90 -45.65 -53.45 -36.74 . . 0 "[ . 1 . 2]"
13 . 1 9 ASN C 1 10 ARG N 1 10 ARG CA 1 10 ARG C -84.50 -44.50 -73.16 -70.48 -71.73 . . 0 "[ . 1 . 2]"
14 . 1 10 ARG N 1 10 ARG CA 1 10 ARG C 1 11 TRP N -61.00 -21.00 -35.57 -37.97 -39.37 . . 0 "[ . 1 . 2]"
15 . 1 10 ARG C 1 11 TRP N 1 11 TRP CA 1 11 TRP C -86.70 -46.70 -63.51 -58.59 -60.72 . . 0 "[ . 1 . 2]"
16 . 1 11 TRP N 1 11 TRP CA 1 11 TRP C 1 12 GLN N -61.70 -21.70 -38.50 -42.64 -34.55 . . 0 "[ . 1 . 2]"
17 . 1 11 TRP C 1 12 GLN N 1 12 GLN CA 1 12 GLN C -84.80 -44.80 -58.87 -62.81 -53.58 . . 0 "[ . 1 . 2]"
18 . 1 12 GLN N 1 12 GLN CA 1 12 GLN C 1 13 ARG N -60.30 -20.30 -44.72 -45.40 -46.13 . . 0 "[ . 1 . 2]"
19 . 1 12 GLN C 1 13 ARG N 1 13 ARG CA 1 13 ARG C -83.50 -43.50 -61.08 -66.87 -57.84 . . 0 "[ . 1 . 2]"
20 . 1 13 ARG N 1 13 ARG CA 1 13 ARG C 1 14 ILE N -58.20 -18.20 -45.94 -45.61 -48.55 . . 0 "[ . 1 . 2]"
21 . 1 13 ARG C 1 14 ILE N 1 14 ILE CA 1 14 ILE C -85.20 -45.20 -57.40 -64.08 -52.05 . . 0 "[ . 1 . 2]"
22 . 1 14 ILE N 1 14 ILE CA 1 14 ILE C 1 15 ALA N -58.80 -18.80 -43.84 -44.69 -45.46 . . 0 "[ . 1 . 2]"
23 . 1 17 LEU C 1 18 SER N 1 18 SER CA 1 18 SER C -83.70 -43.70 -56.20 -53.73 -54.55 . . 0 "[ . 1 . 2]"
24 . 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 GLN N -58.40 -18.40 -44.11 -44.26 -44.64 . . 0 "[ . 1 . 2]"
25 . 1 18 SER C 1 19 GLN N 1 19 GLN CA 1 19 GLN C -84.00 -44.00 -61.33 -64.98 -56.10 . . 0 "[ . 1 . 2]"
26 . 1 19 GLN N 1 19 GLN CA 1 19 GLN C 1 20 SER N -57.50 -17.50 -49.10 -51.25 -51.67 . . 0 "[ . 1 . 2]"
27 . 1 19 GLN C 1 20 SER N 1 20 SER CA 1 20 SER C -85.90 -45.90 -61.64 -65.80 -73.38 . . 0 "[ . 1 . 2]"
28 . 1 20 SER N 1 20 SER CA 1 20 SER C 1 21 LEU N -58.80 -18.80 -53.02 -60.31 -38.79 1.51 5 0 "[ . 1 . 2]"
29 . 1 20 SER C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -85.30 -45.30 -72.08 -79.86 -66.24 . . 0 "[ . 1 . 2]"
30 . 1 21 LEU N 1 21 LEU CA 1 21 LEU C 1 22 LEU N -61.20 -21.20 -22.17 -26.50 -19.02 2.18 11 0 "[ . 1 . 2]"
31 . 1 21 LEU C 1 22 LEU N 1 22 LEU CA 1 22 LEU C -86.10 -46.10 -63.69 -64.86 -65.91 . . 0 "[ . 1 . 2]"
32 . 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 GLU N -60.50 -20.50 -47.94 -55.98 -41.75 . . 0 "[ . 1 . 2]"
33 . 1 22 LEU C 1 23 GLU N 1 23 GLU CA 1 23 GLU C -84.40 -44.40 -60.85 -66.61 -54.78 . . 0 "[ . 1 . 2]"
34 . 1 23 GLU N 1 23 GLU CA 1 23 GLU C 1 24 LEU N -59.90 -19.90 -39.74 -47.99 -24.63 . . 0 "[ . 1 . 2]"
35 . 1 23 GLU C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -84.30 -44.30 -67.16 -65.89 -66.89 . . 0 "[ . 1 . 2]"
36 . 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 ALA N -61.90 -21.90 -37.29 -35.53 -37.53 . . 0 "[ . 1 . 2]"
37 . 1 24 LEU C 1 25 ALA N 1 25 ALA CA 1 25 ALA C -85.00 -45.00 -68.10 -73.67 -61.31 . . 0 "[ . 1 . 2]"
38 . 1 25 ALA N 1 25 ALA CA 1 25 ALA C 1 26 GLN N -59.50 -19.50 -43.87 -49.83 -34.91 . . 0 "[ . 1 . 2]"
39 . 1 25 ALA C 1 26 GLN N 1 26 GLN CA 1 26 GLN C -85.30 -45.30 -72.84 -79.99 -65.35 . . 0 "[ . 1 . 2]"
40 . 1 26 GLN N 1 26 GLN CA 1 26 GLN C 1 27 ARG N -48.30 -8.30 -26.73 -22.74 -25.45 . . 0 "[ . 1 . 2]"
41 . 1 26 GLN C 1 27 ARG N 1 27 ARG CA 1 27 ARG C -106.50 -66.50 -76.93 -85.81 -68.88 . . 0 "[ . 1 . 2]"
42 . 1 27 ARG N 1 27 ARG CA 1 27 ARG C 1 28 GLY N -25.40 14.60 -21.52 -26.61 -8.51 1.21 8 0 "[ . 1 . 2]"
43 . 1 27 ARG C 1 28 GLY N 1 28 GLY CA 1 28 GLY C 61.50 101.50 92.92 87.66 85.91 2.13 5 0 "[ . 1 . 2]"
44 . 1 28 GLY N 1 28 GLY CA 1 28 GLY C 1 29 GLU N -5.10 34.90 4.58 -5.80 12.84 0.70 20 0 "[ . 1 . 2]"
45 . 1 28 GLY C 1 29 GLU N 1 29 GLU CA 1 29 GLU C -108.20 -68.20 -75.55 -86.07 -68.54 . . 0 "[ . 1 . 2]"
46 . 1 29 GLU N 1 29 GLU CA 1 29 GLU C 1 30 TRP N 51.30 91.30 84.63 75.06 92.05 0.75 5 0 "[ . 1 . 2]"
47 . 1 29 GLU C 1 30 TRP N 1 30 TRP CA 1 30 TRP C -89.90 -49.90 -72.05 -70.51 -71.62 . . 0 "[ . 1 . 2]"
48 . 1 30 TRP N 1 30 TRP CA 1 30 TRP C 1 31 ASP N -53.90 -13.90 -35.75 -37.80 -38.81 . . 0 "[ . 1 . 2]"
49 . 1 30 TRP C 1 31 ASP N 1 31 ASP CA 1 31 ASP C -81.60 -41.60 -59.19 -68.22 -53.44 . . 0 "[ . 1 . 2]"
50 . 1 31 ASP N 1 31 ASP CA 1 31 ASP C 1 32 LEU N -63.10 -23.10 -46.50 -50.48 -51.26 . . 0 "[ . 1 . 2]"
51 . 1 31 ASP C 1 32 LEU N 1 32 LEU CA 1 32 LEU C -88.10 -48.10 -73.16 -80.61 -67.76 . . 0 "[ . 1 . 2]"
52 . 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 33 LEU N -58.90 -18.90 -35.80 -36.17 -38.11 . . 0 "[ . 1 . 2]"
53 . 1 32 LEU C 1 33 LEU N 1 33 LEU CA 1 33 LEU C -83.70 -43.70 -57.76 -61.24 -54.22 . . 0 "[ . 1 . 2]"
54 . 1 33 LEU N 1 33 LEU CA 1 33 LEU C 1 34 LEU N -63.80 -23.80 -48.10 -58.73 -37.78 . . 0 "[ . 1 . 2]"
55 . 1 33 LEU C 1 34 LEU N 1 34 LEU CA 1 34 LEU C -85.10 -45.10 -75.08 -76.50 -77.19 . . 0 "[ . 1 . 2]"
56 . 1 34 LEU N 1 34 LEU CA 1 34 LEU C 1 35 GLN N -59.10 -19.10 -25.76 -25.17 -25.84 0.39 12 0 "[ . 1 . 2]"
57 . 1 34 LEU C 1 35 GLN N 1 35 GLN CA 1 35 GLN C -86.80 -46.80 -65.22 -72.46 -58.49 . . 0 "[ . 1 . 2]"
58 . 1 35 GLN N 1 35 GLN CA 1 35 GLN C 1 36 GLN N -57.90 -17.90 -40.07 -45.34 -33.65 . . 0 "[ . 1 . 2]"
59 . 1 35 GLN C 1 36 GLN N 1 36 GLN CA 1 36 GLN C -88.10 -48.10 -84.70 -89.07 -79.97 0.97 13 0 "[ . 1 . 2]"
60 . 1 36 GLN N 1 36 GLN CA 1 36 GLN C 1 37 GLU N -66.70 -6.70 -20.98 -19.43 -21.58 . . 0 "[ . 1 . 2]"
61 . 1 36 GLN C 1 37 GLU N 1 37 GLU CA 1 37 GLU C -94.60 -34.60 -50.66 -57.56 -44.09 . . 0 "[ . 1 . 2]"
62 . 1 37 GLU N 1 37 GLU CA 1 37 GLU C 1 38 VAL N -72.00 -12.00 -56.74 -62.12 -48.93 . . 0 "[ . 1 . 2]"
63 . 1 37 GLU C 1 38 VAL N 1 38 VAL CA 1 38 VAL C -92.70 -32.70 -58.86 -62.73 -55.82 . . 0 "[ . 1 . 2]"
64 . 1 38 VAL N 1 38 VAL CA 1 38 VAL C 1 39 SER N -63.80 -23.80 -44.68 -39.34 -41.27 . . 0 "[ . 1 . 2]"
65 . 1 38 VAL C 1 39 SER N 1 39 SER CA 1 39 SER C -85.60 -45.60 -66.58 -64.19 -65.74 . . 0 "[ . 1 . 2]"
66 . 1 39 SER N 1 39 SER CA 1 39 SER C 1 40 TYR N -58.00 -18.00 -44.17 -53.67 -35.45 . . 0 "[ . 1 . 2]"
67 . 1 39 SER C 1 40 TYR N 1 40 TYR CA 1 40 TYR C -83.20 -43.20 -65.23 -67.96 -68.31 . . 0 "[ . 1 . 2]"
68 . 1 40 TYR N 1 40 TYR CA 1 40 TYR C 1 41 LEU N -65.10 -25.10 -60.27 -57.96 -58.74 . . 0 "[ . 1 . 2]"
69 . 1 40 TYR C 1 41 LEU N 1 41 LEU CA 1 41 LEU C -86.70 -46.70 -61.73 -64.98 -58.38 . . 0 "[ . 1 . 2]"
70 . 1 41 LEU N 1 41 LEU CA 1 41 LEU C 1 42 GLN N -58.20 -18.20 -39.55 -40.90 -41.29 . . 0 "[ . 1 . 2]"
71 . 1 41 LEU C 1 42 GLN N 1 42 GLN CA 1 42 GLN C -85.50 -45.50 -60.01 -63.54 -63.79 . . 0 "[ . 1 . 2]"
72 . 1 42 GLN N 1 42 GLN CA 1 42 GLN C 1 43 SER N -60.20 -20.20 -42.25 -48.30 -34.45 . . 0 "[ . 1 . 2]"
73 . 1 42 GLN C 1 43 SER N 1 43 SER CA 1 43 SER C -86.30 -46.30 -62.35 -61.28 -61.94 . . 0 "[ . 1 . 2]"
74 . 1 43 SER N 1 43 SER CA 1 43 SER C 1 44 ILE N -60.80 -20.80 -39.98 -41.09 -41.91 . . 0 "[ . 1 . 2]"
75 . 1 43 SER C 1 44 ILE N 1 44 ILE CA 1 44 ILE C -86.60 -46.60 -64.37 -60.86 -62.70 . . 0 "[ . 1 . 2]"
76 . 1 44 ILE N 1 44 ILE CA 1 44 ILE C 1 45 GLU N -61.10 -21.10 -46.56 -60.92 -38.24 . . 0 "[ . 1 . 2]"
77 . 1 44 ILE C 1 45 GLU N 1 45 GLU CA 1 45 GLU C -82.40 -42.40 -63.84 -57.93 -58.99 . . 0 "[ . 1 . 2]"
78 . 1 45 GLU N 1 45 GLU CA 1 45 GLU C 1 46 THR N -61.00 -21.00 -38.00 -43.67 -46.19 . . 0 "[ . 1 . 2]"
79 . 1 45 GLU C 1 46 THR N 1 46 THR CA 1 46 THR C -83.50 -43.50 -79.89 -86.88 -71.95 3.38 19 0 "[ . 1 . 2]"
80 . 1 46 THR N 1 46 THR CA 1 46 THR C 1 47 VAL N -63.10 -23.10 -29.39 -23.78 -24.67 0.11 2 0 "[ . 1 . 2]"
81 . 1 46 THR C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -86.90 -46.90 -72.40 -78.38 -67.01 . . 0 "[ . 1 . 2]"
82 . 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 MET N -56.30 -16.30 -31.37 -30.03 -31.27 . . 0 "[ . 1 . 2]"
83 . 1 47 VAL C 1 48 MET N 1 48 MET CA 1 48 MET C -97.70 -37.70 -83.33 -86.10 -87.15 1.05 13 0 "[ . 1 . 2]"
84 . 1 48 MET N 1 48 MET CA 1 48 MET C 1 49 GLU N -60.80 -0.80 -17.64 -20.34 -21.31 0.87 20 0 "[ . 1 . 2]"
85 . 1 48 MET C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -107.50 -67.50 -71.51 -73.27 -77.21 1.90 15 0 "[ . 1 . 2]"
86 . 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 LYS N -30.10 9.90 -30.50 -24.55 -28.01 4.33 16 0 "[ . 1 . 2]"
87 . 1 56 ILE C 1 57 THR N 1 57 THR CA 1 57 THR C -150.70 -75.90 -76.39 -75.58 -75.74 1.63 9 0 "[ . 1 . 2]"
88 . 1 57 THR N 1 57 THR CA 1 57 THR C 1 58 ARG N 113.40 175.10 170.71 164.65 175.95 0.85 13 0 "[ . 1 . 2]"
89 . 1 57 THR C 1 58 ARG N 1 58 ARG CA 1 58 ARG C -100.50 -70.50 -67.14 -68.26 -65.87 4.63 18 0 "[ . 1 . 2]"
90 . 1 58 ARG N 1 58 ARG CA 1 58 ARG C 1 59 SER N -140.20 165.20 -26.74 -30.02 -32.48 . . 0 "[ . 1 . 2]"
91 . 1 58 ARG C 1 59 SER N 1 59 SER CA 1 59 SER C -81.90 -70.90 -71.38 -70.52 -70.68 1.39 15 0 "[ . 1 . 2]"
92 . 1 59 SER N 1 59 SER CA 1 59 SER C 1 60 ILE N -56.80 -16.80 -47.79 -46.67 -47.01 0.07 4 0 "[ . 1 . 2]"
93 . 1 59 SER C 1 60 ILE N 1 60 ILE CA 1 60 ILE C -86.40 -46.40 -66.69 -67.91 -68.90 . . 0 "[ . 1 . 2]"
94 . 1 60 ILE N 1 60 ILE CA 1 60 ILE C 1 61 GLN N -63.40 -23.40 -40.45 -45.19 -35.64 . . 0 "[ . 1 . 2]"
95 . 1 60 ILE C 1 61 GLN N 1 61 GLN CA 1 61 GLN C -81.50 -41.50 -58.97 -63.14 -65.47 . . 0 "[ . 1 . 2]"
96 . 1 61 GLN N 1 61 GLN CA 1 61 GLN C 1 62 ASP N -62.60 -22.60 -41.75 -38.86 -39.95 . . 0 "[ . 1 . 2]"
97 . 1 61 GLN C 1 62 ASP N 1 62 ASP CA 1 62 ASP C -85.10 -45.10 -65.42 -72.20 -59.66 . . 0 "[ . 1 . 2]"
98 . 1 62 ASP N 1 62 ASP CA 1 62 ASP C 1 63 MET N -59.00 -19.00 -45.74 -51.27 -35.35 . . 0 "[ . 1 . 2]"
99 . 1 62 ASP C 1 63 MET N 1 63 MET CA 1 63 MET C -84.70 -44.70 -58.24 -58.80 -59.67 . . 0 "[ . 1 . 2]"
100 . 1 63 MET N 1 63 MET CA 1 63 MET C 1 64 VAL N -65.40 -25.40 -56.95 -53.66 -54.37 0.45 18 0 "[ . 1 . 2]"
101 . 1 63 MET C 1 64 VAL N 1 64 VAL CA 1 64 VAL C -83.80 -43.80 -70.18 -71.99 -73.15 . . 0 "[ . 1 . 2]"
102 . 1 64 VAL N 1 64 VAL CA 1 64 VAL C 1 65 ALA N -63.60 -23.60 -28.77 -40.60 -21.40 2.20 18 0 "[ . 1 . 2]"
103 . 1 64 VAL C 1 65 ALA N 1 65 ALA CA 1 65 ALA C -82.10 -42.10 -63.28 -61.62 -62.55 . . 0 "[ . 1 . 2]"
104 . 1 65 ALA N 1 65 ALA CA 1 65 ALA C 1 66 GLY N -59.00 -19.00 -37.69 -39.94 -43.23 . . 0 "[ . 1 . 2]"
105 . 1 65 ALA C 1 66 GLY N 1 66 GLY CA 1 66 GLY C -84.80 -44.80 -63.63 -67.53 -58.90 . . 0 "[ . 1 . 2]"
106 . 1 66 GLY N 1 66 GLY CA 1 66 GLY C 1 67 TYR N -60.20 -20.20 -42.73 -47.34 -36.92 . . 0 "[ . 1 . 2]"
107 . 1 66 GLY C 1 67 TYR N 1 67 TYR CA 1 67 TYR C -85.50 -45.50 -66.37 -71.86 -60.20 . . 0 "[ . 1 . 2]"
108 . 1 67 TYR N 1 67 TYR CA 1 67 TYR C 1 68 ILE N -62.20 -22.20 -37.78 -39.60 -40.91 . . 0 "[ . 1 . 2]"
109 . 1 67 TYR C 1 68 ILE N 1 68 ILE CA 1 68 ILE C -84.30 -44.30 -71.31 -75.43 -67.54 . . 0 "[ . 1 . 2]"
110 . 1 68 ILE N 1 68 ILE CA 1 68 ILE C 1 69 LYS N -62.60 -22.60 -40.10 -39.90 -40.94 . . 0 "[ . 1 . 2]"
111 . 1 68 ILE C 1 69 LYS N 1 69 LYS CA 1 69 LYS C -83.90 -43.90 -59.67 -64.24 -54.84 . . 0 "[ . 1 . 2]"
112 . 1 69 LYS N 1 69 LYS CA 1 69 LYS C 1 70 GLN N -58.60 -18.60 -42.61 -41.96 -42.58 . . 0 "[ . 1 . 2]"
113 . 1 69 LYS C 1 70 GLN N 1 70 GLN CA 1 70 GLN C -85.00 -45.00 -62.69 -69.08 -58.44 . . 0 "[ . 1 . 2]"
114 . 1 70 GLN N 1 70 GLN CA 1 70 GLN C 1 71 THR N -59.40 -19.40 -50.80 -52.19 -52.93 . . 0 "[ . 1 . 2]"
115 . 1 70 GLN C 1 71 THR N 1 71 THR CA 1 71 THR C -85.30 -45.30 -66.75 -65.91 -66.80 . . 0 "[ . 1 . 2]"
116 . 1 71 THR N 1 71 THR CA 1 71 THR C 1 72 LEU N -64.10 -24.10 -32.46 -44.22 -26.91 . . 0 "[ . 1 . 2]"
117 . 1 71 THR C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -84.40 -44.40 -66.72 -65.92 -67.31 . . 0 "[ . 1 . 2]"
118 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 ASP N -64.30 -24.30 -45.01 -48.75 -39.63 . . 0 "[ . 1 . 2]"
119 . 1 72 LEU C 1 73 ASP N 1 73 ASP CA 1 73 ASP C -84.20 -44.20 -60.12 -65.71 -54.97 . . 0 "[ . 1 . 2]"
120 . 1 73 ASP N 1 73 ASP CA 1 73 ASP C 1 74 ASN N -60.20 -20.20 -53.39 -51.74 -52.24 . . 0 "[ . 1 . 2]"
121 . 1 73 ASP C 1 74 ASN N 1 74 ASN CA 1 74 ASN C -87.70 -47.70 -65.03 -68.71 -61.27 . . 0 "[ . 1 . 2]"
122 . 1 74 ASN N 1 74 ASN CA 1 74 ASN C 1 75 GLU N -57.60 -17.60 -42.36 -41.88 -42.26 . . 0 "[ . 1 . 2]"
123 . 1 74 ASN C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -83.20 -43.20 -74.44 -74.90 -75.66 . . 0 "[ . 1 . 2]"
124 . 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 GLN N -61.90 -21.90 -24.93 -28.02 -20.73 1.17 17 0 "[ . 1 . 2]"
125 . 1 75 GLU C 1 76 GLN N 1 76 GLN CA 1 76 GLN C -84.00 -44.00 -69.89 -70.22 -71.60 . . 0 "[ . 1 . 2]"
126 . 1 76 GLN N 1 76 GLN CA 1 76 GLN C 1 77 LEU N -61.10 -21.10 -40.81 -48.99 -34.73 . . 0 "[ . 1 . 2]"
127 . 1 76 GLN C 1 77 LEU N 1 77 LEU CA 1 77 LEU C -84.70 -44.70 -68.97 -69.33 -69.42 . . 0 "[ . 1 . 2]"
128 . 1 77 LEU N 1 77 LEU CA 1 77 LEU C 1 78 LEU N -63.20 -23.20 -32.35 -31.99 -32.48 . . 0 "[ . 1 . 2]"
129 . 1 77 LEU C 1 78 LEU N 1 78 LEU CA 1 78 LEU C -83.80 -43.80 -64.77 -64.03 -64.63 . . 0 "[ . 1 . 2]"
130 . 1 78 LEU N 1 78 LEU CA 1 78 LEU C 1 79 LYS N -61.90 -21.90 -44.50 -49.51 -37.58 . . 0 "[ . 1 . 2]"
131 . 1 78 LEU C 1 79 LYS N 1 79 LYS CA 1 79 LYS C -82.70 -42.70 -54.27 -53.81 -53.98 . . 0 "[ . 1 . 2]"
132 . 1 79 LYS N 1 79 LYS CA 1 79 LYS C 1 80 GLY N -60.70 -20.70 -53.11 -54.71 -56.04 . . 0 "[ . 1 . 2]"
133 . 1 79 LYS C 1 80 GLY N 1 80 GLY CA 1 80 GLY C -83.80 -43.80 -66.74 -73.01 -61.49 . . 0 "[ . 1 . 2]"
134 . 1 80 GLY N 1 80 GLY CA 1 80 GLY C 1 81 LEU N -62.80 -22.80 -49.70 -45.93 -46.47 . . 0 "[ . 1 . 2]"
135 . 1 80 GLY C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -85.90 -45.90 -61.76 -64.94 -56.83 . . 0 "[ . 1 . 2]"
136 . 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 LEU N -62.70 -22.70 -55.32 -59.90 -50.08 . . 0 "[ . 1 . 2]"
137 . 1 81 LEU C 1 82 LEU N 1 82 LEU CA 1 82 LEU C -84.00 -44.00 -66.65 -68.02 -69.06 . . 0 "[ . 1 . 2]"
138 . 1 82 LEU N 1 82 LEU CA 1 82 LEU C 1 83 GLN N -62.80 -22.80 -28.74 -36.01 -22.56 0.24 12 0 "[ . 1 . 2]"
139 . 1 82 LEU C 1 83 GLN N 1 83 GLN CA 1 83 GLN C -84.50 -44.50 -62.00 -58.89 -61.08 . . 0 "[ . 1 . 2]"
140 . 1 83 GLN N 1 83 GLN CA 1 83 GLN C 1 84 GLN N -57.00 -17.00 -43.15 -49.76 -37.02 . . 0 "[ . 1 . 2]"
141 . 1 83 GLN C 1 84 GLN N 1 84 GLN CA 1 84 GLN C -86.30 -46.30 -60.59 -64.28 -58.02 . . 0 "[ . 1 . 2]"
142 . 1 84 GLN N 1 84 GLN CA 1 84 GLN C 1 85 ARG N -59.60 -19.60 -48.52 -49.07 -49.34 . . 0 "[ . 1 . 2]"
143 . 1 84 GLN C 1 85 ARG N 1 85 ARG CA 1 85 ARG C -86.90 -46.90 -58.90 -62.68 -54.43 . . 0 "[ . 1 . 2]"
144 . 1 85 ARG N 1 85 ARG CA 1 85 ARG C 1 86 LEU N -59.90 -19.90 -48.43 -50.00 -50.76 . . 0 "[ . 1 . 2]"
145 . 1 85 ARG C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -84.00 -44.00 -66.68 -73.04 -61.87 . . 0 "[ . 1 . 2]"
146 . 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 ASP N -62.10 -22.10 -33.88 -39.20 -25.19 . . 0 "[ . 1 . 2]"
147 . 1 86 LEU C 1 87 ASP N 1 87 ASP CA 1 87 ASP C -84.10 -44.10 -64.66 -62.62 -63.97 . . 0 "[ . 1 . 2]"
148 . 1 87 ASP N 1 87 ASP CA 1 87 ASP C 1 88 GLU N -62.90 -22.90 -44.04 -43.57 -44.40 . . 0 "[ . 1 . 2]"
149 . 1 87 ASP C 1 88 GLU N 1 88 GLU CA 1 88 GLU C -84.30 -44.30 -66.51 -70.54 -60.69 . . 0 "[ . 1 . 2]"
150 . 1 88 GLU N 1 88 GLU CA 1 88 GLU C 1 89 LEU N -63.90 -23.90 -48.58 -48.29 -49.02 . . 0 "[ . 1 . 2]"
151 . 1 88 GLU C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -84.10 -44.10 -60.60 -64.71 -56.01 . . 0 "[ . 1 . 2]"
152 . 1 89 LEU N 1 89 LEU CA 1 89 LEU C 1 90 SER N -63.10 -23.10 -42.73 -52.28 -33.31 . . 0 "[ . 1 . 2]"
153 . 1 89 LEU C 1 90 SER N 1 90 SER CA 1 90 SER C -81.90 -41.90 -63.20 -62.28 -63.04 . . 0 "[ . 1 . 2]"
154 . 1 90 SER N 1 90 SER CA 1 90 SER C 1 91 SER N -59.50 -19.50 -40.16 -35.79 -37.61 . . 0 "[ . 1 . 2]"
155 . 1 90 SER C 1 91 SER N 1 91 SER CA 1 91 SER C -86.80 -46.80 -64.84 -65.43 -67.41 . . 0 "[ . 1 . 2]"
156 . 1 91 SER N 1 91 SER CA 1 91 SER C 1 92 LEU N -58.90 -18.90 -38.72 -46.77 -30.39 . . 0 "[ . 1 . 2]"
157 . 1 91 SER C 1 92 LEU N 1 92 LEU CA 1 92 LEU C -86.80 -46.80 -68.00 -70.52 -72.89 . . 0 "[ . 1 . 2]"
158 . 1 92 LEU N 1 92 LEU CA 1 92 LEU C 1 93 ILE N -63.50 -23.50 -45.68 -40.09 -41.06 . . 0 "[ . 1 . 2]"
159 . 1 92 LEU C 1 93 ILE N 1 93 ILE CA 1 93 ILE C -86.50 -46.50 -61.48 -60.79 -61.50 . . 0 "[ . 1 . 2]"
160 . 1 93 ILE N 1 93 ILE CA 1 93 ILE C 1 94 GLY N -52.30 -12.30 -41.14 -52.58 -34.65 0.28 9 0 "[ . 1 . 2]"
161 . 1 93 ILE C 1 94 GLY N 1 94 GLY CA 1 94 GLY C -91.00 -51.00 -62.15 -62.52 -63.37 . . 0 "[ . 1 . 2]"
162 . 1 94 GLY N 1 94 GLY CA 1 94 GLY C 1 95 GLN N -38.10 7.10 -27.59 -39.19 -13.98 1.09 15 0 "[ . 1 . 2]"
163 . 1 96 VAL C 1 97 LEU N 1 97 LEU CA 1 97 LEU C -98.40 -58.40 -85.15 -99.03 -72.47 0.63 17 0 "[ . 1 . 2]"
164 . 1 97 LEU N 1 97 LEU CA 1 97 LEU C 1 98 PHE N 113.40 153.40 113.23 113.28 112.38 2.83 11 0 "[ . 1 . 2]"
165 . 1 10 ARG N 1 10 ARG CA 1 10 ARG CB 1 10 ARG CG -70.00 -50.00 -63.62 -61.35 -62.21 . . 0 "[ . 1 . 2]"
166 . 1 10 ARG CA 1 10 ARG CB 1 10 ARG CG 1 10 ARG CD 170.00 -170.00 179.46 173.75 -173.40 . . 0 "[ . 1 . 2]"
167 . 1 35 GLN N 1 35 GLN CA 1 35 GLN CB 1 35 GLN CG 170.00 -170.00 -177.76 -173.17 -175.46 . . 0 "[ . 1 . 2]"
168 . 1 35 GLN CA 1 35 GLN CB 1 35 GLN CG 1 35 GLN CD 50.00 70.00 61.37 61.71 60.93 . . 0 "[ . 1 . 2]"
169 . 1 37 GLU N 1 37 GLU CA 1 37 GLU CB 1 37 GLU CG 170.00 -170.00 172.38 172.67 171.07 2.15 16 0 "[ . 1 . 2]"
170 . 1 37 GLU CA 1 37 GLU CB 1 37 GLU CG 1 37 GLU CD 170.00 -170.00 -168.15 -167.45 -167.81 3.31 5 0 "[ . 1 . 2]"
171 . 1 37 GLU CA 1 37 GLU CB 1 37 GLU CG 1 37 GLU CD 170.00 -170.00 -168.15 -167.45 -167.81 3.31 5 0 "[ . 1 . 2]"
172 . 1 75 GLU N 1 75 GLU CA 1 75 GLU CB 1 75 GLU CG 170.00 -170.00 -176.71 178.20 -173.33 . . 0 "[ . 1 . 2]"
173 . 1 75 GLU CA 1 75 GLU CB 1 75 GLU CG 1 75 GLU CD 170.00 -170.00 168.86 167.89 167.74 2.90 15 0 "[ . 1 . 2]"
174 . 1 76 GLN N 1 76 GLN CA 1 76 GLN CB 1 76 GLN CG 170.00 -170.00 179.35 178.44 178.27 . . 0 "[ . 1 . 2]"
175 . 1 76 GLN CA 1 76 GLN CB 1 76 GLN CG 1 76 GLN CD 170.00 -170.00 -177.43 -174.87 -177.15 . . 0 "[ . 1 . 2]"
176 . 1 30 TRP N 1 30 TRP CA 1 30 TRP CB 1 30 TRP CG -53.00 -33.00 -51.57 -52.03 -52.62 0.60 9 0 "[ . 1 . 2]"
177 . 1 7 PHE N 1 7 PHE CA 1 7 PHE CB 1 7 PHE CG 170.00 -170.00 173.44 174.00 172.98 0.87 15 0 "[ . 1 . 2]"
178 . 1 63 MET N 1 63 MET CA 1 63 MET CB 1 63 MET CG -70.00 -50.00 -62.23 -61.95 -62.69 0.29 14 0 "[ . 1 . 2]"
179 . 1 63 MET CA 1 63 MET CB 1 63 MET CG 1 63 MET SD 170.00 -170.00 -173.23 165.38 -168.23 4.62 14 0 "[ . 1 . 2]"
180 . 1 44 ILE N 1 44 ILE CA 1 44 ILE CB 1 44 ILE CG1 -70.00 -50.00 -56.02 -61.49 -51.30 . . 0 "[ . 1 . 2]"
181 . 1 44 ILE CA 1 44 ILE CB 1 44 ILE CG1 1 44 ILE CD1 170.00 -170.00 175.64 -179.96 176.55 . . 0 "[ . 1 . 2]"
182 . 1 68 ILE N 1 68 ILE CA 1 68 ILE CB 1 68 ILE CG1 -70.00 -50.00 -55.05 -52.75 -53.91 0.74 18 0 "[ . 1 . 2]"
183 . 1 68 ILE CA 1 68 ILE CB 1 68 ILE CG1 1 68 ILE CD1 170.00 -170.00 173.32 170.04 176.27 . . 0 "[ . 1 . 2]"
184 . 1 60 ILE N 1 60 ILE CA 1 60 ILE CB 1 60 ILE CG1 -70.00 -50.00 -61.75 -65.38 -58.69 . . 0 "[ . 1 . 2]"
185 . 1 60 ILE CA 1 60 ILE CB 1 60 ILE CG1 1 60 ILE CD1 170.00 -170.00 174.14 171.13 178.90 . . 0 "[ . 1 . 2]"
186 . 1 8 ILE N 1 8 ILE CA 1 8 ILE CB 1 8 ILE CG1 -70.00 -50.00 -60.55 -65.01 -55.85 . . 0 "[ . 1 . 2]"
187 . 1 8 ILE CA 1 8 ILE CB 1 8 ILE CG1 1 8 ILE CD1 170.00 -170.00 170.92 169.29 172.97 0.71 11 0 "[ . 1 . 2]"
188 . 1 14 ILE N 1 14 ILE CA 1 14 ILE CB 1 14 ILE CG1 -70.00 -50.00 -64.87 -69.31 -59.35 . . 0 "[ . 1 . 2]"
189 . 1 14 ILE CA 1 14 ILE CB 1 14 ILE CG1 1 14 ILE CD1 170.00 -170.00 171.45 169.12 177.53 0.88 10 0 "[ . 1 . 2]"
190 . 1 93 ILE N 1 93 ILE CA 1 93 ILE CB 1 93 ILE CG1 -70.00 -50.00 -60.96 -63.17 -63.44 . . 0 "[ . 1 . 2]"
191 . 1 93 ILE CA 1 93 ILE CB 1 93 ILE CG1 1 93 ILE CD1 170.00 -170.00 171.36 173.53 173.22 1.30 8 0 "[ . 1 . 2]"
192 . 1 16 LEU N 1 16 LEU CA 1 16 LEU CB 1 16 LEU CG -70.00 -50.00 -63.88 -71.12 -57.47 1.12 15 0 "[ . 1 . 2]"
193 . 1 16 LEU CA 1 16 LEU CB 1 16 LEU CG 1 16 LEU CD1 170.00 -170.00 175.92 169.10 -178.57 0.90 15 0 "[ . 1 . 2]"
194 . 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG -70.00 -50.00 -67.77 -71.70 -62.35 1.70 13 0 "[ . 1 . 2]"
195 . 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 1 17 LEU CD1 170.00 -170.00 174.12 169.89 179.19 0.11 2 0 "[ . 1 . 2]"
196 . 1 22 LEU N 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 170.00 -170.00 177.41 173.31 -179.43 . . 0 "[ . 1 . 2]"
197 . 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 1 22 LEU CD1 50.00 70.00 63.90 61.65 66.83 . . 0 "[ . 1 . 2]"
198 . 1 24 LEU N 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG -70.00 -50.00 -59.80 -65.65 -54.56 . . 0 "[ . 1 . 2]"
199 . 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG 1 24 LEU CD1 170.00 -170.00 170.88 171.33 171.10 1.26 8 0 "[ . 1 . 2]"
200 . 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG -70.00 -50.00 -60.97 -56.47 -57.17 . . 0 "[ . 1 . 2]"
201 . 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG 1 32 LEU CD1 170.00 -170.00 -179.42 -179.73 179.38 . . 0 "[ . 1 . 2]"
202 . 1 34 LEU N 1 34 LEU CA 1 34 LEU CB 1 34 LEU CG -70.00 -50.00 -61.59 -59.63 -60.17 . . 0 "[ . 1 . 2]"
203 . 1 34 LEU CA 1 34 LEU CB 1 34 LEU CG 1 34 LEU CD1 170.00 -170.00 170.42 168.93 174.62 1.07 16 0 "[ . 1 . 2]"
204 . 1 41 LEU N 1 41 LEU CA 1 41 LEU CB 1 41 LEU CG -70.00 -50.00 -63.45 -67.88 -60.69 . . 0 "[ . 1 . 2]"
205 . 1 41 LEU CA 1 41 LEU CB 1 41 LEU CG 1 41 LEU CD1 170.00 -170.00 175.41 176.99 176.68 . . 0 "[ . 1 . 2]"
206 . 1 72 LEU N 1 72 LEU CA 1 72 LEU CB 1 72 LEU CG -70.00 -50.00 -70.97 -70.69 -70.79 2.76 5 0 "[ . 1 . 2]"
207 . 1 72 LEU CA 1 72 LEU CB 1 72 LEU CG 1 72 LEU CD1 170.00 -170.00 173.11 173.63 173.39 . . 0 "[ . 1 . 2]"
208 . 1 77 LEU N 1 77 LEU CA 1 77 LEU CB 1 77 LEU CG -70.00 -50.00 -61.34 -67.06 -56.36 . . 0 "[ . 1 . 2]"
209 . 1 77 LEU CA 1 77 LEU CB 1 77 LEU CG 1 77 LEU CD1 170.00 -170.00 177.81 179.26 178.60 . . 0 "[ . 1 . 2]"
210 . 1 78 LEU N 1 78 LEU CA 1 78 LEU CB 1 78 LEU CG -70.00 -50.00 -64.56 -68.45 -60.13 . . 0 "[ . 1 . 2]"
211 . 1 78 LEU CA 1 78 LEU CB 1 78 LEU CG 1 78 LEU CD1 170.00 -170.00 172.17 170.15 173.92 . . 0 "[ . 1 . 2]"
212 . 1 81 LEU N 1 81 LEU CA 1 81 LEU CB 1 81 LEU CG 165.00 -165.00 -167.09 -166.70 -166.80 0.98 14 0 "[ . 1 . 2]"
213 . 1 81 LEU CA 1 81 LEU CB 1 81 LEU CG 1 81 LEU CD1 165.00 -165.00 163.19 162.79 162.58 3.17 12 0 "[ . 1 . 2]"
214 . 1 82 LEU N 1 82 LEU CA 1 82 LEU CB 1 82 LEU CG -70.00 -50.00 -56.55 -58.08 -58.46 . . 0 "[ . 1 . 2]"
215 . 1 82 LEU CA 1 82 LEU CB 1 82 LEU CG 1 82 LEU CD1 170.00 -170.00 -179.49 -179.22 -179.41 . . 0 "[ . 1 . 2]"
216 . 1 89 LEU N 1 89 LEU CA 1 89 LEU CB 1 89 LEU CG -70.00 -50.00 -63.75 -61.69 -62.72 . . 0 "[ . 1 . 2]"
217 . 1 89 LEU CA 1 89 LEU CB 1 89 LEU CG 1 89 LEU CD1 170.00 -170.00 176.88 177.91 177.38 . . 0 "[ . 1 . 2]"
218 . 1 92 LEU N 1 92 LEU CA 1 92 LEU CB 1 92 LEU CG -70.00 -50.00 -62.69 -59.37 -61.04 . . 0 "[ . 1 . 2]"
219 . 1 92 LEU CA 1 92 LEU CB 1 92 LEU CG 1 92 LEU CD1 170.00 -170.00 176.34 172.92 -173.86 . . 0 "[ . 1 . 2]"
220 . 1 86 LEU N 1 86 LEU CA 1 86 LEU CB 1 86 LEU CG -70.00 -50.00 -66.93 -67.31 -67.39 . . 0 "[ . 1 . 2]"
221 . 1 86 LEU CA 1 86 LEU CB 1 86 LEU CG 1 86 LEU CD1 170.00 -170.00 177.93 -176.85 -177.89 . . 0 "[ . 1 . 2]"
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