NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
628530 |
5wah   |
30313 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5wah
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 165
_TA_constraint_stats_list.Viol_count 342
_TA_constraint_stats_list.Viol_total 8695.26
_TA_constraint_stats_list.Viol_max 5.72
_TA_constraint_stats_list.Viol_rms 0.52
_TA_constraint_stats_list.Viol_average_all_restraints 0.13
_TA_constraint_stats_list.Viol_average_violations_only 1.27
_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 15 GLY C 1 16 LYS N 1 16 LYS CA 1 16 LYS C -77.80 -56.60 -66.46 -60.14 -63.37 1.85 10 0 "[ . 1 . 2]"
2 . 1 16 LYS N 1 16 LYS CA 1 16 LYS C 1 17 ARG N -51.90 -27.10 -43.55 -47.61 -48.78 2.69 13 0 "[ . 1 . 2]"
3 . 1 16 LYS C 1 17 ARG N 1 17 ARG CA 1 17 ARG C -77.40 -55.60 -64.57 -78.58 -55.32 1.18 10 0 "[ . 1 . 2]"
4 . 1 17 ARG N 1 17 ARG CA 1 17 ARG C 1 18 GLU N -53.70 -27.30 -38.47 -52.38 -26.12 1.18 17 0 "[ . 1 . 2]"
5 . 1 17 ARG C 1 18 GLU N 1 18 GLU CA 1 18 GLU C -75.70 -55.70 -63.28 -78.30 -55.32 2.60 15 0 "[ . 1 . 2]"
6 . 1 18 GLU N 1 18 GLU CA 1 18 GLU C 1 19 LYS N -49.40 -29.40 -37.59 -48.37 -27.77 1.63 20 0 "[ . 1 . 2]"
7 . 1 18 GLU C 1 19 LYS N 1 19 LYS CA 1 19 LYS C -78.00 -58.00 -62.26 -57.27 -57.68 0.73 2 0 "[ . 1 . 2]"
8 . 1 19 LYS N 1 19 LYS CA 1 19 LYS C 1 20 GLN N -51.00 -28.60 -44.37 -43.94 -45.55 1.71 15 0 "[ . 1 . 2]"
9 . 1 19 LYS C 1 20 GLN N 1 20 GLN CA 1 20 GLN C -76.40 -56.40 -68.57 -76.64 -60.26 0.24 16 0 "[ . 1 . 2]"
10 . 1 20 GLN N 1 20 GLN CA 1 20 GLN C 1 21 LEU N -49.50 -26.10 -34.44 -38.17 -39.90 . . 0 "[ . 1 . 2]"
11 . 1 20 GLN C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -73.70 -53.70 -71.56 -76.36 -64.84 2.66 8 0 "[ . 1 . 2]"
12 . 1 21 LEU N 1 21 LEU CA 1 21 LEU C 1 22 GLN N -52.50 -32.50 -35.26 -34.28 -37.01 1.92 20 0 "[ . 1 . 2]"
13 . 1 21 LEU C 1 22 GLN N 1 22 GLN CA 1 22 GLN C -73.90 -53.90 -65.29 -53.91 -58.51 1.79 19 0 "[ . 1 . 2]"
14 . 1 22 GLN N 1 22 GLN CA 1 22 GLN C 1 23 GLN N -50.60 -30.60 -39.24 -49.67 -31.66 . . 0 "[ . 1 . 2]"
15 . 1 22 GLN C 1 23 GLN N 1 23 GLN CA 1 23 GLN C -76.30 -56.30 -64.98 -62.64 -63.68 1.00 18 0 "[ . 1 . 2]"
16 . 1 23 GLN N 1 23 GLN CA 1 23 GLN C 1 24 TRP N -51.90 -31.90 -41.62 -50.81 -34.95 . . 0 "[ . 1 . 2]"
17 . 1 23 GLN C 1 24 TRP N 1 24 TRP CA 1 24 TRP C -73.60 -53.60 -65.13 -63.35 -63.80 . . 0 "[ . 1 . 2]"
18 . 1 24 TRP N 1 24 TRP CA 1 24 TRP C 1 25 LYS N -53.20 -32.80 -38.47 -37.78 -38.66 0.89 19 0 "[ . 1 . 2]"
19 . 1 24 TRP C 1 25 LYS N 1 25 LYS CA 1 25 LYS C -70.70 -50.70 -58.22 -59.03 -59.37 . . 0 "[ . 1 . 2]"
20 . 1 25 LYS N 1 25 LYS CA 1 25 LYS C 1 26 ASN N -51.60 -31.60 -46.15 -53.11 -33.49 1.51 9 0 "[ . 1 . 2]"
21 . 1 25 LYS C 1 26 ASN N 1 26 ASN CA 1 26 ASN C -75.30 -55.30 -59.62 -59.23 -60.10 2.12 12 0 "[ . 1 . 2]"
22 . 1 26 ASN N 1 26 ASN CA 1 26 ASN C 1 27 ASN N -50.50 -30.50 -42.49 -49.03 -35.43 . . 0 "[ . 1 . 2]"
23 . 1 26 ASN C 1 27 ASN N 1 27 ASN CA 1 27 ASN C -77.50 -57.50 -62.88 -58.40 -58.96 . . 0 "[ . 1 . 2]"
24 . 1 27 ASN N 1 27 ASN CA 1 27 ASN C 1 28 LEU N -49.20 -28.00 -46.53 -48.96 -49.82 1.92 8 0 "[ . 1 . 2]"
25 . 1 27 ASN C 1 28 LEU N 1 28 LEU CA 1 28 LEU C -75.40 -55.40 -61.41 -64.19 -64.35 0.61 11 0 "[ . 1 . 2]"
26 . 1 28 LEU N 1 28 LEU CA 1 28 LEU C 1 29 LYS N -53.00 -32.00 -46.78 -54.93 -39.54 1.93 2 0 "[ . 1 . 2]"
27 . 1 28 LEU C 1 29 LYS N 1 29 LYS CA 1 29 LYS C -72.60 -52.60 -63.46 -64.68 -65.90 . . 0 "[ . 1 . 2]"
28 . 1 29 LYS N 1 29 LYS CA 1 29 LYS C 1 30 ASN N -49.60 -29.60 -35.81 -44.65 -29.92 . . 0 "[ . 1 . 2]"
29 . 1 29 LYS C 1 30 ASN N 1 30 ASN CA 1 30 ASN C -75.50 -55.50 -64.31 -62.50 -63.26 . . 0 "[ . 1 . 2]"
30 . 1 30 ASN N 1 30 ASN CA 1 30 ASN C 1 31 ASP N -50.40 -30.40 -46.30 -51.10 -51.62 1.31 5 0 "[ . 1 . 2]"
31 . 1 30 ASN C 1 31 ASP N 1 31 ASP CA 1 31 ASP C -75.10 -55.10 -63.14 -72.14 -57.17 . . 0 "[ . 1 . 2]"
32 . 1 31 ASP N 1 31 ASP CA 1 31 ASP C 1 32 VAL N -50.30 -30.30 -41.60 -50.13 -30.69 . . 0 "[ . 1 . 2]"
33 . 1 31 ASP C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -74.70 -54.70 -59.16 -56.25 -57.64 0.84 2 0 "[ . 1 . 2]"
34 . 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 ASP N -53.20 -33.20 -37.94 -42.64 -32.78 0.42 11 0 "[ . 1 . 2]"
35 . 1 32 VAL C 1 33 ASP N 1 33 ASP CA 1 33 ASP C -77.60 -54.60 -75.96 -76.98 -77.47 2.40 5 0 "[ . 1 . 2]"
36 . 1 33 ASP N 1 33 ASP CA 1 33 ASP C 1 34 ASN N -44.80 -14.60 -34.20 -45.32 -23.12 0.52 20 0 "[ . 1 . 2]"
37 . 1 33 ASP C 1 34 ASN N 1 34 ASN CA 1 34 ASN C -115.00 -67.80 -77.56 -77.37 -80.09 . . 0 "[ . 1 . 2]"
38 . 1 34 ASN N 1 34 ASN CA 1 34 ASN C 1 35 THR N -29.60 24.80 -26.55 -32.63 -9.11 3.03 6 0 "[ . 1 . 2]"
39 . 1 34 ASN C 1 35 THR N 1 35 THR CA 1 35 THR C 166.80 -39.80 -76.06 -70.83 -73.12 . . 0 "[ . 1 . 2]"
40 . 1 35 THR N 1 35 THR CA 1 35 THR C 1 36 ILE N 146.70 -155.10 162.94 167.91 166.80 . . 0 "[ . 1 . 2]"
41 . 1 35 THR C 1 36 ILE N 1 36 ILE CA 1 36 ILE C -119.40 -83.40 -84.29 -94.85 -81.55 1.85 13 0 "[ . 1 . 2]"
42 . 1 36 ILE N 1 36 ILE CA 1 36 ILE C 1 37 LEU N -29.20 24.40 24.49 24.78 24.61 2.04 13 0 "[ . 1 . 2]"
43 . 1 36 ILE C 1 37 LEU N 1 37 LEU CA 1 37 LEU C -85.80 -51.20 -60.26 -65.14 -54.35 . . 0 "[ . 1 . 2]"
44 . 1 37 LEU N 1 37 LEU CA 1 37 LEU C 1 38 SER N 121.10 161.70 151.43 157.21 155.87 . . 0 "[ . 1 . 2]"
45 . 1 37 LEU C 1 38 SER N 1 38 SER CA 1 38 SER C -86.30 -59.10 -65.95 -79.24 -59.94 . . 0 "[ . 1 . 2]"
46 . 1 38 SER N 1 38 SER CA 1 38 SER C 1 39 HIS N 145.90 175.90 156.80 143.98 175.18 1.92 13 0 "[ . 1 . 2]"
47 . 1 38 SER C 1 39 HIS N 1 39 HIS CA 1 39 HIS C -68.10 -48.10 -53.51 -57.72 -46.99 1.11 13 0 "[ . 1 . 2]"
48 . 1 39 HIS N 1 39 HIS CA 1 39 HIS C 1 40 GLU N -51.50 -30.70 -41.87 -39.15 -40.45 0.04 4 0 "[ . 1 . 2]"
49 . 1 39 HIS C 1 40 GLU N 1 40 GLU CA 1 40 GLU C -75.20 -52.40 -67.72 -66.09 -67.85 0.06 7 0 "[ . 1 . 2]"
50 . 1 40 GLU N 1 40 GLU CA 1 40 GLU C 1 41 GLN N -52.30 -32.10 -42.22 -51.43 -34.22 . . 0 "[ . 1 . 2]"
51 . 1 40 GLU C 1 41 GLN N 1 41 GLN CA 1 41 GLN C -76.40 -56.40 -62.69 -63.98 -65.72 0.95 12 0 "[ . 1 . 2]"
52 . 1 41 GLN N 1 41 GLN CA 1 41 GLN C 1 42 LYS N -51.70 -31.70 -42.55 -52.29 -35.80 0.59 2 0 "[ . 1 . 2]"
53 . 1 41 GLN C 1 42 LYS N 1 42 LYS CA 1 42 LYS C -71.00 -51.00 -62.45 -61.42 -62.29 . . 0 "[ . 1 . 2]"
54 . 1 42 LYS N 1 42 LYS CA 1 42 LYS C 1 43 ASN N -52.40 -32.40 -48.44 -55.78 -36.20 3.38 19 0 "[ . 1 . 2]"
55 . 1 42 LYS C 1 43 ASN N 1 43 ASN CA 1 43 ASN C -73.90 -53.90 -60.65 -57.42 -59.12 1.96 13 0 "[ . 1 . 2]"
56 . 1 43 ASN N 1 43 ASN CA 1 43 ASN C 1 44 GLU N -53.40 -29.60 -39.76 -49.42 -26.43 3.17 17 0 "[ . 1 . 2]"
57 . 1 43 ASN C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -74.20 -54.20 -65.53 -75.52 -58.46 1.32 6 0 "[ . 1 . 2]"
58 . 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 PHE N -53.90 -33.90 -55.28 -59.62 -49.29 5.72 11 4 "[ .- *1+ . * 2]"
59 . 1 44 GLU C 1 45 PHE N 1 45 PHE CA 1 45 PHE C -73.30 -53.30 -61.58 -62.00 -64.71 0.14 11 0 "[ . 1 . 2]"
60 . 1 45 PHE N 1 45 PHE CA 1 45 PHE C 1 46 LYS N -54.10 -34.10 -48.48 -45.67 -47.24 1.36 10 0 "[ . 1 . 2]"
61 . 1 45 PHE C 1 46 LYS N 1 46 LYS CA 1 46 LYS C -72.20 -52.20 -56.39 -65.85 -50.93 1.27 8 0 "[ . 1 . 2]"
62 . 1 46 LYS N 1 46 LYS CA 1 46 LYS C 1 47 THR N -51.10 -31.10 -44.25 -52.36 -33.96 1.26 18 0 "[ . 1 . 2]"
63 . 1 46 LYS C 1 47 THR N 1 47 THR CA 1 47 THR C -73.90 -53.90 -63.52 -74.58 -57.04 0.68 6 0 "[ . 1 . 2]"
64 . 1 47 THR N 1 47 THR CA 1 47 THR C 1 48 LYS N -52.50 -32.50 -48.25 -54.01 -40.51 1.51 20 0 "[ . 1 . 2]"
65 . 1 47 THR C 1 48 LYS N 1 48 LYS CA 1 48 LYS C -76.00 -56.00 -59.86 -64.73 -54.39 1.61 4 0 "[ . 1 . 2]"
66 . 1 48 LYS N 1 48 LYS CA 1 48 LYS C 1 49 ILE N -49.60 -29.20 -40.34 -43.99 -46.04 . . 0 "[ . 1 . 2]"
67 . 1 48 LYS C 1 49 ILE N 1 49 ILE CA 1 49 ILE C -74.10 -54.10 -63.70 -68.47 -55.81 . . 0 "[ . 1 . 2]"
68 . 1 49 ILE N 1 49 ILE CA 1 49 ILE C 1 50 ASP N -52.50 -32.50 -39.60 -40.57 -42.58 . . 0 "[ . 1 . 2]"
69 . 1 49 ILE C 1 50 ASP N 1 50 ASP CA 1 50 ASP C -76.40 -56.40 -70.36 -70.15 -70.73 1.46 10 0 "[ . 1 . 2]"
70 . 1 50 ASP N 1 50 ASP CA 1 50 ASP C 1 51 GLU N -39.30 -17.30 -37.74 -36.51 -38.71 4.66 5 0 "[ . 1 . 2]"
71 . 1 50 ASP C 1 51 GLU N 1 51 GLU CA 1 51 GLU C -99.60 -75.80 -78.26 -78.01 -79.91 3.39 7 0 "[ . 1 . 2]"
72 . 1 51 GLU N 1 51 GLU CA 1 51 GLU C 1 52 THR N -26.20 8.00 -20.47 -30.00 4.55 3.80 8 0 "[ . 1 . 2]"
73 . 1 51 GLU C 1 52 THR N 1 52 THR CA 1 52 THR C -133.60 -16.20 -100.71 -128.25 -84.18 . . 0 "[ . 1 . 2]"
74 . 1 52 THR N 1 52 THR CA 1 52 THR C 1 53 ASN N 118.80 164.20 119.95 121.14 119.63 3.72 19 0 "[ . 1 . 2]"
75 . 1 53 ASN C 1 54 ASP N 1 54 ASP CA 1 54 ASP C -164.90 -51.30 -89.11 -121.83 -56.90 . . 0 "[ . 1 . 2]"
76 . 1 54 ASP N 1 54 ASP CA 1 54 ASP C 1 55 SER N 102.80 171.60 126.77 112.39 108.05 . . 0 "[ . 1 . 2]"
77 . 1 54 ASP C 1 55 SER N 1 55 SER CA 1 55 SER C -72.70 -48.10 -64.57 -73.97 -57.49 1.27 20 0 "[ . 1 . 2]"
78 . 1 55 SER N 1 55 SER CA 1 55 SER C 1 56 ASP N -53.80 -22.80 -42.85 -52.38 -31.28 . . 0 "[ . 1 . 2]"
79 . 1 55 SER C 1 56 ASP N 1 56 ASP CA 1 56 ASP C -73.80 -53.80 -66.67 -65.77 -67.84 0.15 9 0 "[ . 1 . 2]"
80 . 1 56 ASP N 1 56 ASP CA 1 56 ASP C 1 57 ALA N -47.70 -27.70 -39.12 -39.67 -40.07 2.34 4 0 "[ . 1 . 2]"
81 . 1 56 ASP C 1 57 ALA N 1 57 ALA CA 1 57 ALA C -76.80 -56.80 -71.55 -78.27 -64.30 1.47 15 0 "[ . 1 . 2]"
82 . 1 57 ALA N 1 57 ALA CA 1 57 ALA C 1 58 LEU N -49.20 -27.80 -32.83 -41.76 -25.57 2.23 10 0 "[ . 1 . 2]"
83 . 1 57 ALA C 1 58 LEU N 1 58 LEU CA 1 58 LEU C -74.90 -54.90 -70.32 -75.22 -64.02 0.32 17 0 "[ . 1 . 2]"
84 . 1 58 LEU N 1 58 LEU CA 1 58 LEU C 1 59 LEU N -53.10 -33.10 -34.53 -36.05 -37.35 1.46 4 0 "[ . 1 . 2]"
85 . 1 58 LEU C 1 59 LEU N 1 59 LEU CA 1 59 LEU C -76.10 -56.10 -63.33 -71.05 -57.31 . . 0 "[ . 1 . 2]"
86 . 1 59 LEU N 1 59 LEU CA 1 59 LEU C 1 60 GLU N -48.80 -28.80 -36.84 -36.94 -37.20 . . 0 "[ . 1 . 2]"
87 . 1 59 LEU C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -75.60 -55.60 -68.91 -68.08 -68.19 . . 0 "[ . 1 . 2]"
88 . 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 LEU N -51.00 -31.00 -48.00 -52.10 -40.39 1.10 11 0 "[ . 1 . 2]"
89 . 1 60 GLU C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -74.00 -54.00 -59.91 -59.37 -60.27 . . 0 "[ . 1 . 2]"
90 . 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 GLU N -53.30 -33.30 -37.09 -42.51 -32.77 0.53 14 0 "[ . 1 . 2]"
91 . 1 61 LEU C 1 62 GLU N 1 62 GLU CA 1 62 GLU C -72.80 -52.80 -64.50 -71.46 -60.77 . . 0 "[ . 1 . 2]"
92 . 1 62 GLU N 1 62 GLU CA 1 62 GLU C 1 63 ASN N -50.50 -30.50 -47.52 -52.68 -32.64 2.18 20 0 "[ . 1 . 2]"
93 . 1 62 GLU C 1 63 ASN N 1 63 ASN CA 1 63 ASN C -74.90 -54.90 -62.90 -69.66 -57.69 . . 0 "[ . 1 . 2]"
94 . 1 63 ASN N 1 63 ASN CA 1 63 ASN C 1 64 GLN N -53.60 -32.00 -38.23 -50.33 -30.34 1.66 16 0 "[ . 1 . 2]"
95 . 1 63 ASN C 1 64 GLN N 1 64 GLN CA 1 64 GLN C -76.80 -56.60 -69.77 -71.82 -72.88 . . 0 "[ . 1 . 2]"
96 . 1 64 GLN N 1 64 GLN CA 1 64 GLN C 1 65 PHE N -50.20 -29.60 -43.39 -49.03 -50.18 2.98 15 0 "[ . 1 . 2]"
97 . 1 64 GLN C 1 65 PHE N 1 65 PHE CA 1 65 PHE C -78.00 -58.00 -72.20 -75.05 -75.75 . . 0 "[ . 1 . 2]"
98 . 1 65 PHE N 1 65 PHE CA 1 65 PHE C 1 66 ASN N -44.60 -24.60 -35.69 -31.33 -31.58 3.17 3 0 "[ . 1 . 2]"
99 . 1 65 PHE C 1 66 ASN N 1 66 ASN CA 1 66 ASN C -76.10 -56.10 -68.38 -75.76 -62.29 . . 0 "[ . 1 . 2]"
100 . 1 66 ASN N 1 66 ASN CA 1 66 ASN C 1 67 GLU N -50.10 -30.10 -37.67 -46.06 -29.58 0.52 9 0 "[ . 1 . 2]"
101 . 1 66 ASN C 1 67 GLU N 1 67 GLU CA 1 67 GLU C -77.90 -57.90 -67.80 -66.60 -67.26 . . 0 "[ . 1 . 2]"
102 . 1 67 GLU N 1 67 GLU CA 1 67 GLU C 1 68 THR N -49.60 -29.60 -48.32 -51.38 -40.22 1.78 12 0 "[ . 1 . 2]"
103 . 1 67 GLU C 1 68 THR N 1 68 THR CA 1 68 THR C -74.30 -54.30 -58.57 -60.74 -54.77 . . 0 "[ . 1 . 2]"
104 . 1 68 THR N 1 68 THR CA 1 68 THR C 1 69 ASN N -52.20 -32.20 -45.10 -40.39 -41.76 . . 0 "[ . 1 . 2]"
105 . 1 68 THR C 1 69 ASN N 1 69 ASN CA 1 69 ASN C -73.40 -53.40 -61.00 -62.39 -64.12 0.76 8 0 "[ . 1 . 2]"
106 . 1 69 ASN N 1 69 ASN CA 1 69 ASN C 1 70 ARG N -52.50 -32.50 -44.37 -49.99 -37.51 . . 0 "[ . 1 . 2]"
107 . 1 69 ASN C 1 70 ARG N 1 70 ARG CA 1 70 ARG C -74.20 -54.20 -59.33 -60.83 -61.20 0.44 10 0 "[ . 1 . 2]"
108 . 1 70 ARG N 1 70 ARG CA 1 70 ARG C 1 71 LEU N -52.00 -32.00 -47.79 -49.00 -49.54 1.48 10 0 "[ . 1 . 2]"
109 . 1 70 ARG C 1 71 LEU N 1 71 LEU CA 1 71 LEU C -76.80 -56.80 -61.54 -57.35 -58.94 0.00 10 0 "[ . 1 . 2]"
110 . 1 71 LEU N 1 71 LEU CA 1 71 LEU C 1 72 LEU N -50.90 -27.10 -35.02 -41.79 -26.09 1.01 19 0 "[ . 1 . 2]"
111 . 1 71 LEU C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -74.90 -54.90 -67.25 -73.99 -61.35 . . 0 "[ . 1 . 2]"
112 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 HIS N -49.90 -29.50 -42.54 -42.40 -44.05 0.97 12 0 "[ . 1 . 2]"
113 . 1 72 LEU C 1 73 HIS N 1 73 HIS CA 1 73 HIS C -75.30 -55.30 -66.53 -72.48 -60.68 . . 0 "[ . 1 . 2]"
114 . 1 73 HIS N 1 73 HIS CA 1 73 HIS C 1 74 ILE N -51.80 -31.80 -36.88 -43.96 -30.17 1.63 3 0 "[ . 1 . 2]"
115 . 1 73 HIS C 1 74 ILE N 1 74 ILE CA 1 74 ILE C -75.40 -55.40 -69.06 -73.52 -75.63 3.57 3 0 "[ . 1 . 2]"
116 . 1 74 ILE N 1 74 ILE CA 1 74 ILE C 1 75 LYS N -52.90 -32.90 -45.28 -47.68 -49.31 2.36 11 0 "[ . 1 . 2]"
117 . 1 74 ILE C 1 75 LYS N 1 75 LYS CA 1 75 LYS C -77.90 -57.90 -65.35 -57.73 -61.91 1.29 17 0 "[ . 1 . 2]"
118 . 1 75 LYS N 1 75 LYS CA 1 75 LYS C 1 76 GLN N -47.40 -25.00 -46.03 -48.56 -49.24 4.77 3 0 "[ . 1 . 2]"
119 . 1 75 LYS C 1 76 GLN N 1 76 GLN CA 1 76 GLN C -77.90 -57.90 -70.54 -66.11 -67.46 . . 0 "[ . 1 . 2]"
120 . 1 76 GLN N 1 76 GLN CA 1 76 GLN C 1 77 HIS N -49.40 -24.60 -31.36 -47.18 -22.96 1.64 7 0 "[ . 1 . 2]"
121 . 1 76 GLN C 1 77 HIS N 1 77 HIS CA 1 77 HIS C -78.10 -58.10 -60.21 -66.71 -57.02 1.08 5 0 "[ . 1 . 2]"
122 . 1 77 HIS N 1 77 HIS CA 1 77 HIS C 1 78 GLU N -46.70 -26.70 -41.61 -51.29 -33.65 4.59 17 0 "[ . 1 . 2]"
123 . 1 77 HIS C 1 78 GLU N 1 78 GLU CA 1 78 GLU C -77.40 -57.40 -62.01 -62.50 -63.34 0.51 8 0 "[ . 1 . 2]"
124 . 1 78 GLU N 1 78 GLU CA 1 78 GLU C 1 79 GLU N -48.50 -28.50 -37.90 -46.70 -27.54 0.96 12 0 "[ . 1 . 2]"
125 . 1 78 GLU C 1 79 GLU N 1 79 GLU CA 1 79 GLU C -77.30 -57.30 -70.26 -70.80 -72.36 2.50 16 0 "[ . 1 . 2]"
126 . 1 79 GLU N 1 79 GLU CA 1 79 GLU C 1 80 VAL N -48.50 -26.70 -39.28 -50.22 -23.00 3.70 16 0 "[ . 1 . 2]"
127 . 1 79 GLU C 1 80 VAL N 1 80 VAL CA 1 80 VAL C -79.20 -55.80 -64.90 -60.68 -62.66 0.38 9 0 "[ . 1 . 2]"
128 . 1 80 VAL N 1 80 VAL CA 1 80 VAL C 1 81 GLU N -48.80 -27.60 -38.15 -45.10 -48.93 2.52 12 0 "[ . 1 . 2]"
129 . 1 80 VAL C 1 81 GLU N 1 81 GLU CA 1 81 GLU C -77.60 -57.60 -66.75 -74.15 -56.09 1.51 12 0 "[ . 1 . 2]"
130 . 1 81 GLU N 1 81 GLU CA 1 81 GLU C 1 82 LYS N -49.40 -29.40 -40.98 -54.02 -29.83 4.62 17 0 "[ . 1 . 2]"
131 . 1 81 GLU C 1 82 LYS N 1 82 LYS CA 1 82 LYS C -78.30 -58.30 -67.21 -79.59 -60.31 1.29 17 0 "[ . 1 . 2]"
132 . 1 82 LYS N 1 82 LYS CA 1 82 LYS C 1 83 ASP N -50.80 -24.60 -39.32 -44.38 -45.52 2.44 9 0 "[ . 1 . 2]"
133 . 1 82 LYS C 1 83 ASP N 1 83 ASP CA 1 83 ASP C -77.40 -57.40 -73.51 -78.75 -81.11 3.71 1 0 "[ . 1 . 2]"
134 . 1 83 ASP N 1 83 ASP CA 1 83 ASP C 1 84 LYS N -48.10 -26.30 -33.87 -41.25 -44.45 2.42 4 0 "[ . 1 . 2]"
135 . 1 83 ASP C 1 84 LYS N 1 84 LYS CA 1 84 LYS C -76.70 -56.70 -66.42 -77.25 -55.82 0.88 4 0 "[ . 1 . 2]"
136 . 1 84 LYS N 1 84 LYS CA 1 84 LYS C 1 85 LYS N -47.70 -26.70 -40.30 -22.89 -26.17 3.81 2 0 "[ . 1 . 2]"
137 . 1 20 GLN N 1 20 GLN CA 1 20 GLN CB 1 20 GLN CG -90.00 -30.00 -56.66 -49.76 -52.50 . . 0 "[ . 1 . 2]"
138 . 1 22 GLN N 1 22 GLN CA 1 22 GLN CB 1 22 GLN CG -90.00 -30.00 -64.65 -62.68 -66.72 . . 0 "[ . 1 . 2]"
139 . 1 23 GLN N 1 23 GLN CA 1 23 GLN CB 1 23 GLN CG -90.00 -30.00 -62.75 -55.79 -56.86 . . 0 "[ . 1 . 2]"
140 . 1 26 ASN N 1 26 ASN CA 1 26 ASN CB 1 26 ASN CG -90.00 -30.00 -64.28 -61.71 -63.11 . . 0 "[ . 1 . 2]"
141 . 1 27 ASN N 1 27 ASN CA 1 27 ASN CB 1 27 ASN CG -90.00 -30.00 -66.24 -80.48 -53.10 . . 0 "[ . 1 . 2]"
142 . 1 30 ASN N 1 30 ASN CA 1 30 ASN CB 1 30 ASN CG -90.00 -30.00 -72.54 -79.92 -80.53 . . 0 "[ . 1 . 2]"
143 . 1 31 ASP N 1 31 ASP CA 1 31 ASP CB 1 31 ASP CG -90.00 -30.00 -71.23 -80.15 -59.21 . . 0 "[ . 1 . 2]"
144 . 1 32 VAL N 1 32 VAL CA 1 32 VAL CB 1 32 VAL CG1 150.00 -150.00 172.83 171.15 169.95 . . 0 "[ . 1 . 2]"
145 . 1 34 ASN N 1 34 ASN CA 1 34 ASN CB 1 34 ASN CG -90.00 -30.00 -68.78 -66.25 -67.66 . . 0 "[ . 1 . 2]"
146 . 1 35 THR N 1 35 THR CA 1 35 THR CB 1 35 THR OG1 30.00 90.00 50.31 44.50 53.96 . . 0 "[ . 1 . 2]"
147 . 1 37 LEU N 1 37 LEU CA 1 37 LEU CB 1 37 LEU CG -90.00 -30.00 -52.01 -49.39 -49.99 . . 0 "[ . 1 . 2]"
148 . 1 41 GLN N 1 41 GLN CA 1 41 GLN CB 1 41 GLN CG -90.00 -30.00 -65.17 -67.15 -69.78 . . 0 "[ . 1 . 2]"
149 . 1 43 ASN N 1 43 ASN CA 1 43 ASN CB 1 43 ASN CG -90.00 -30.00 -70.75 -83.62 -60.64 . . 0 "[ . 1 . 2]"
150 . 1 47 THR N 1 47 THR CA 1 47 THR CB 1 47 THR OG1 -90.00 -30.00 -58.65 -66.01 -52.39 . . 0 "[ . 1 . 2]"
151 . 1 49 ILE N 1 49 ILE CA 1 49 ILE CB 1 49 ILE CG1 -90.00 -30.00 -63.83 -68.92 -58.44 . . 0 "[ . 1 . 2]"
152 . 1 50 ASP N 1 50 ASP CA 1 50 ASP CB 1 50 ASP CG -90.00 -30.00 -73.12 -85.53 -64.82 . . 0 "[ . 1 . 2]"
153 . 1 53 ASN N 1 53 ASN CA 1 53 ASN CB 1 53 ASN CG -90.00 -30.00 -63.15 -63.17 -65.87 . . 0 "[ . 1 . 2]"
154 . 1 54 ASP N 1 54 ASP CA 1 54 ASP CB 1 54 ASP CG 150.00 -150.00 -175.55 175.23 -168.94 . . 0 "[ . 1 . 2]"
155 . 1 56 ASP N 1 56 ASP CA 1 56 ASP CB 1 56 ASP CG -90.00 -30.00 -62.93 -72.07 -53.45 . . 0 "[ . 1 . 2]"
156 . 1 59 LEU N 1 59 LEU CA 1 59 LEU CB 1 59 LEU CG -90.00 -30.00 -69.05 -74.58 -62.34 . . 0 "[ . 1 . 2]"
157 . 1 64 GLN N 1 64 GLN CA 1 64 GLN CB 1 64 GLN CG -90.00 -30.00 -73.55 -73.80 -75.14 4.25 14 0 "[ . 1 . 2]"
158 . 1 66 ASN N 1 66 ASN CA 1 66 ASN CB 1 66 ASN CG -90.00 -30.00 -72.92 -69.28 -69.56 . . 0 "[ . 1 . 2]"
159 . 1 68 THR N 1 68 THR CA 1 68 THR CB 1 68 THR OG1 -90.00 -30.00 -59.67 -65.89 -53.94 . . 0 "[ . 1 . 2]"
160 . 1 71 LEU N 1 71 LEU CA 1 71 LEU CB 1 71 LEU CG -90.00 -30.00 -61.69 -70.63 -55.13 . . 0 "[ . 1 . 2]"
161 . 1 72 LEU N 1 72 LEU CA 1 72 LEU CB 1 72 LEU CG -90.00 -30.00 -67.03 -70.29 -76.56 . . 0 "[ . 1 . 2]"
162 . 1 74 ILE N 1 74 ILE CA 1 74 ILE CB 1 74 ILE CG1 -90.00 -30.00 -59.56 -67.93 -52.63 . . 0 "[ . 1 . 2]"
163 . 1 78 GLU N 1 78 GLU CA 1 78 GLU CB 1 78 GLU CG -90.00 -30.00 -55.98 -54.22 -54.92 . . 0 "[ . 1 . 2]"
164 . 1 80 VAL N 1 80 VAL CA 1 80 VAL CB 1 80 VAL CG1 150.00 -150.00 174.54 166.80 -177.44 . . 0 "[ . 1 . 2]"
165 . 1 83 ASP N 1 83 ASP CA 1 83 ASP CB 1 83 ASP CG -90.00 -30.00 -69.16 -83.61 -58.22 . . 0 "[ . 1 . 2]"
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