NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
580979 |
2mr5   |
25061 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mr5
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 158
_TA_constraint_stats_list.Viol_count 866
_TA_constraint_stats_list.Viol_total 33405.41
_TA_constraint_stats_list.Viol_max 10.86
_TA_constraint_stats_list.Viol_rms 1.22
_TA_constraint_stats_list.Viol_average_all_restraints 0.53
_TA_constraint_stats_list.Viol_average_violations_only 1.93
_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 THR C 1 4 VAL N 1 4 VAL CA 1 4 VAL C -129.20 -93.20 -107.87 -110.19 -112.80 2.08 18 0 "[ . 1 . 2]"
2 . 1 4 VAL N 1 4 VAL CA 1 4 VAL C 1 5 VAL N 117.80 137.80 113.56 114.54 114.13 6.42 19 6 "[ * . 1- * .* +*]"
3 . 1 4 VAL C 1 5 VAL N 1 5 VAL CA 1 5 VAL C -127.10 -95.10 -115.38 -116.42 -117.80 0.53 9 0 "[ . 1 . 2]"
4 . 1 5 VAL N 1 5 VAL CA 1 5 VAL C 1 6 ILE N 114.50 134.50 115.74 125.17 116.67 4.63 15 0 "[ . 1 . 2]"
5 . 1 5 VAL C 1 6 ILE N 1 6 ILE CA 1 6 ILE C -123.50 -94.90 -105.25 -124.18 -97.92 0.68 7 0 "[ . 1 . 2]"
6 . 1 6 ILE N 1 6 ILE CA 1 6 ILE C 1 7 VAL N 105.80 138.60 110.08 110.16 109.04 1.21 20 0 "[ . 1 . 2]"
7 . 1 6 ILE C 1 7 VAL N 1 7 VAL CA 1 7 VAL C -127.20 -90.40 -87.36 -87.56 -87.87 4.95 2 0 "[ . 1 . 2]"
8 . 1 7 VAL N 1 7 VAL CA 1 7 VAL C 1 8 VAL N 108.50 139.90 113.47 116.33 112.80 2.34 10 0 "[ . 1 . 2]"
9 . 1 7 VAL C 1 8 VAL N 1 8 VAL CA 1 8 VAL C -131.50 -102.30 -116.39 -131.67 -101.23 1.07 10 0 "[ . 1 . 2]"
10 . 1 8 VAL N 1 8 VAL CA 1 8 VAL C 1 9 SER N 113.90 148.30 142.80 139.83 136.79 2.10 20 0 "[ . 1 . 2]"
11 . 1 12 GLU C 1 13 ARG N 1 13 ARG CA 1 13 ARG C -74.10 -54.10 -69.57 -75.14 -60.20 1.04 20 0 "[ . 1 . 2]"
12 . 1 13 ARG N 1 13 ARG CA 1 13 ARG C 1 14 ILE N -49.20 -28.40 -26.87 -31.90 -24.22 4.18 16 0 "[ . 1 . 2]"
13 . 1 13 ARG C 1 14 ILE N 1 14 ILE CA 1 14 ILE C -80.50 -59.70 -65.73 -75.33 -59.03 0.67 4 0 "[ . 1 . 2]"
14 . 1 14 ILE N 1 14 ILE CA 1 14 ILE C 1 15 LEU N -50.70 -30.70 -42.19 -42.21 -43.40 0.31 1 0 "[ . 1 . 2]"
15 . 1 14 ILE C 1 15 LEU N 1 15 LEU CA 1 15 LEU C -72.90 -52.90 -62.71 -67.95 -58.51 . . 0 "[ . 1 . 2]"
16 . 1 15 LEU N 1 15 LEU CA 1 15 LEU C 1 16 GLU N -52.50 -32.50 -38.29 -48.44 -30.37 2.13 1 0 "[ . 1 . 2]"
17 . 1 15 LEU C 1 16 GLU N 1 16 GLU CA 1 16 GLU C -73.10 -53.10 -70.66 -74.45 -63.71 1.35 4 0 "[ . 1 . 2]"
18 . 1 16 GLU N 1 16 GLU CA 1 16 GLU C 1 17 GLU N -50.90 -30.90 -45.05 -50.81 -32.74 . . 0 "[ . 1 . 2]"
19 . 1 16 GLU C 1 17 GLU N 1 17 GLU CA 1 17 GLU C -75.50 -55.50 -62.29 -61.93 -62.97 . . 0 "[ . 1 . 2]"
20 . 1 17 GLU N 1 17 GLU CA 1 17 GLU C 1 18 LEU N -50.40 -30.40 -48.67 -52.80 -30.35 2.40 20 0 "[ . 1 . 2]"
21 . 1 17 GLU C 1 18 LEU N 1 18 LEU CA 1 18 LEU C -75.10 -55.10 -68.20 -78.03 -61.72 2.93 6 0 "[ . 1 . 2]"
22 . 1 18 LEU N 1 18 LEU CA 1 18 LEU C 1 19 LEU N -51.40 -30.20 -28.94 -28.14 -28.63 4.37 5 0 "[ . 1 . 2]"
23 . 1 18 LEU C 1 19 LEU N 1 19 LEU CA 1 19 LEU C -72.10 -52.10 -59.08 -58.91 -59.74 . . 0 "[ . 1 . 2]"
24 . 1 19 LEU N 1 19 LEU CA 1 19 LEU C 1 20 GLU N -53.20 -33.20 -50.47 -49.24 -50.51 0.78 7 0 "[ . 1 . 2]"
25 . 1 19 LEU C 1 20 GLU N 1 20 GLU CA 1 20 GLU C -73.50 -53.50 -65.67 -72.26 -61.61 . . 0 "[ . 1 . 2]"
26 . 1 20 GLU N 1 20 GLU CA 1 20 GLU C 1 21 VAL N -51.40 -31.40 -30.83 -33.79 -28.02 3.38 13 0 "[ . 1 . 2]"
27 . 1 20 GLU C 1 21 VAL N 1 21 VAL CA 1 21 VAL C -75.60 -55.60 -64.26 -70.71 -58.32 . . 0 "[ . 1 . 2]"
28 . 1 21 VAL N 1 21 VAL CA 1 21 VAL C 1 22 VAL N -50.50 -30.50 -42.14 -46.88 -51.62 3.47 1 0 "[ . 1 . 2]"
29 . 1 21 VAL C 1 22 VAL N 1 22 VAL CA 1 22 VAL C -74.90 -54.90 -70.17 -72.71 -73.89 2.02 5 0 "[ . 1 . 2]"
30 . 1 22 VAL N 1 22 VAL CA 1 22 VAL C 1 23 LEU N -54.70 -34.70 -44.43 -54.08 -37.32 . . 0 "[ . 1 . 2]"
31 . 1 22 VAL C 1 23 LEU N 1 23 LEU CA 1 23 LEU C -75.30 -55.30 -61.73 -59.80 -60.58 0.41 3 0 "[ . 1 . 2]"
32 . 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 LYS N -50.70 -23.10 -42.76 -41.26 -42.07 2.58 12 0 "[ . 1 . 2]"
33 . 1 23 LEU C 1 24 LYS N 1 24 LYS CA 1 24 LYS C -83.20 -61.20 -75.53 -79.32 -79.83 0.98 15 0 "[ . 1 . 2]"
34 . 1 24 LYS N 1 24 LYS CA 1 24 LYS C 1 25 SER N -43.50 -14.90 -30.10 -44.29 -17.67 0.79 14 0 "[ . 1 . 2]"
35 . 1 31 THR C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -150.10 -116.50 -124.26 -135.26 -113.03 3.47 1 0 "[ . 1 . 2]"
36 . 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 ARG N 116.20 148.20 117.74 121.25 116.44 3.83 7 0 "[ . 1 . 2]"
37 . 1 32 VAL C 1 33 ARG N 1 33 ARG CA 1 33 ARG C -121.20 -79.40 -102.42 -121.85 -82.26 0.65 15 0 "[ . 1 . 2]"
38 . 1 33 ARG N 1 33 ARG CA 1 33 ARG C 1 34 THR N 97.60 140.40 101.66 92.18 123.33 5.42 20 1 "[ . 1 . +]"
39 . 1 37 LYS C 1 38 GLU N 1 38 GLU CA 1 38 GLU C -74.80 -54.80 -65.65 -74.94 -75.63 1.36 6 0 "[ . 1 . 2]"
40 . 1 38 GLU N 1 38 GLU CA 1 38 GLU C 1 39 LYS N -48.50 -28.50 -35.27 -34.65 -35.32 1.02 17 0 "[ . 1 . 2]"
41 . 1 38 GLU C 1 39 LYS N 1 39 LYS CA 1 39 LYS C -79.50 -59.50 -67.01 -80.19 -57.96 1.54 10 0 "[ . 1 . 2]"
42 . 1 39 LYS N 1 39 LYS CA 1 39 LYS C 1 40 VAL N -49.30 -29.30 -41.84 -50.52 -30.94 1.22 3 0 "[ . 1 . 2]"
43 . 1 39 LYS C 1 40 VAL N 1 40 VAL CA 1 40 VAL C -73.30 -53.30 -58.93 -69.57 -52.02 1.28 7 0 "[ . 1 . 2]"
44 . 1 40 VAL N 1 40 VAL CA 1 40 VAL C 1 41 LYS N -55.20 -35.20 -39.87 -39.14 -41.59 4.52 20 0 "[ . 1 . 2]"
45 . 1 40 VAL C 1 41 LYS N 1 41 LYS CA 1 41 LYS C -71.40 -51.40 -63.91 -61.73 -61.97 0.02 6 0 "[ . 1 . 2]"
46 . 1 41 LYS N 1 41 LYS CA 1 41 LYS C 1 42 GLU N -51.80 -31.80 -39.04 -46.38 -30.35 1.45 19 0 "[ . 1 . 2]"
47 . 1 41 LYS C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -73.60 -53.60 -65.87 -74.58 -57.70 0.98 19 0 "[ . 1 . 2]"
48 . 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 GLU N -52.70 -32.70 -39.30 -31.77 -34.41 3.07 2 0 "[ . 1 . 2]"
49 . 1 42 GLU C 1 43 GLU N 1 43 GLU CA 1 43 GLU C -76.10 -56.10 -71.27 -78.02 -61.69 1.92 13 0 "[ . 1 . 2]"
50 . 1 43 GLU N 1 43 GLU CA 1 43 GLU C 1 44 ILE N -49.20 -29.20 -32.34 -44.07 -19.69 9.51 13 2 "[ . 1 + . -2]"
51 . 1 43 GLU C 1 44 ILE N 1 44 ILE CA 1 44 ILE C -74.00 -54.00 -60.39 -63.16 -64.38 1.91 13 0 "[ . 1 . 2]"
52 . 1 44 ILE N 1 44 ILE CA 1 44 ILE C 1 45 GLU N -54.10 -34.10 -43.23 -36.96 -38.08 . . 0 "[ . 1 . 2]"
53 . 1 44 ILE C 1 45 GLU N 1 45 GLU CA 1 45 GLU C -73.50 -53.50 -61.06 -58.79 -61.19 0.19 15 0 "[ . 1 . 2]"
54 . 1 45 GLU N 1 45 GLU CA 1 45 GLU C 1 46 LYS N -50.90 -30.90 -41.68 -38.72 -41.14 1.94 19 0 "[ . 1 . 2]"
55 . 1 45 GLU C 1 46 LYS N 1 46 LYS CA 1 46 LYS C -73.50 -53.50 -66.26 -74.55 -60.47 1.05 19 0 "[ . 1 . 2]"
56 . 1 46 LYS N 1 46 LYS CA 1 46 LYS C 1 47 ALA N -53.50 -33.50 -39.77 -54.05 -30.17 3.33 3 0 "[ . 1 . 2]"
57 . 1 46 LYS C 1 47 ALA N 1 47 ALA CA 1 47 ALA C -73.40 -53.40 -66.32 -66.86 -67.99 . . 0 "[ . 1 . 2]"
58 . 1 47 ALA N 1 47 ALA CA 1 47 ALA C 1 48 ARG N -52.20 -32.20 -46.16 -36.43 -43.02 4.23 15 0 "[ . 1 . 2]"
59 . 1 47 ALA C 1 48 ARG N 1 48 ARG CA 1 48 ARG C -73.90 -53.90 -69.10 -76.80 -62.30 2.90 17 0 "[ . 1 . 2]"
60 . 1 48 ARG N 1 48 ARG CA 1 48 ARG C 1 49 LYS N -49.40 -29.40 -31.84 -43.39 -26.18 3.22 18 0 "[ . 1 . 2]"
61 . 1 54 ILE C 1 55 VAL N 1 55 VAL CA 1 55 VAL C -125.90 -98.70 -111.52 -125.11 -96.80 1.90 13 0 "[ . 1 . 2]"
62 . 1 55 VAL N 1 55 VAL CA 1 55 VAL C 1 56 ILE N 109.90 138.10 114.16 115.99 111.89 3.76 18 0 "[ . 1 . 2]"
63 . 1 55 VAL C 1 56 ILE N 1 56 ILE CA 1 56 ILE C -131.50 -94.50 -102.75 -98.28 -99.93 1.04 20 0 "[ . 1 . 2]"
64 . 1 56 ILE N 1 56 ILE CA 1 56 ILE C 1 57 PHE N 112.80 137.80 117.61 129.50 124.00 2.15 20 0 "[ . 1 . 2]"
65 . 1 56 ILE C 1 57 PHE N 1 57 PHE CA 1 57 PHE C -119.10 -95.90 -97.50 -119.64 -92.19 3.71 14 0 "[ . 1 . 2]"
66 . 1 57 PHE N 1 57 PHE CA 1 57 PHE C 1 58 ILE N 107.20 142.00 116.07 115.20 113.53 0.39 1 0 "[ . 1 . 2]"
67 . 1 60 GLY C 1 61 ALA N 1 61 ALA CA 1 61 ALA C -76.80 -56.80 -68.63 -62.11 -65.52 . . 0 "[ . 1 . 2]"
68 . 1 61 ALA N 1 61 ALA CA 1 61 ALA C 1 62 TYR N -53.10 -24.50 -41.54 -23.38 -28.85 1.12 2 0 "[ . 1 . 2]"
69 . 1 61 ALA C 1 62 TYR N 1 62 TYR CA 1 62 TYR C -76.80 -54.60 -71.28 -69.10 -71.03 0.89 15 0 "[ . 1 . 2]"
70 . 1 62 TYR N 1 62 TYR CA 1 62 TYR C 1 63 GLU N -53.90 -33.90 -26.44 -30.54 -23.04 10.86 16 17 "[* ****** ******+*-*2]"
71 . 1 62 TYR C 1 63 GLU N 1 63 GLU CA 1 63 GLU C -73.20 -53.20 -53.67 -61.59 -49.25 3.95 12 0 "[ . 1 . 2]"
72 . 1 63 GLU N 1 63 GLU CA 1 63 GLU C 1 64 GLU N -49.50 -29.50 -29.32 -28.36 -29.00 6.06 15 1 "[ . 1 + 2]"
73 . 1 63 GLU C 1 64 GLU N 1 64 GLU CA 1 64 GLU C -75.00 -55.00 -55.33 -53.44 -53.57 4.12 15 0 "[ . 1 . 2]"
74 . 1 64 GLU N 1 64 GLU CA 1 64 GLU C 1 65 VAL N -50.90 -30.90 -34.39 -33.52 -35.19 3.62 12 0 "[ . 1 . 2]"
75 . 1 64 GLU C 1 65 VAL N 1 65 VAL CA 1 65 VAL C -76.90 -56.90 -64.78 -77.63 -54.53 2.37 15 0 "[ . 1 . 2]"
76 . 1 65 VAL N 1 65 VAL CA 1 65 VAL C 1 66 VAL N -50.70 -30.70 -31.99 -30.54 -32.92 5.86 2 1 "[ + . 1 . 2]"
77 . 1 65 VAL C 1 66 VAL N 1 66 VAL CA 1 66 VAL C -74.20 -54.20 -55.43 -54.14 -54.97 3.30 6 0 "[ . 1 . 2]"
78 . 1 66 VAL N 1 66 VAL CA 1 66 VAL C 1 67 ARG N -53.70 -33.70 -34.43 -31.35 -31.77 3.62 3 0 "[ . 1 . 2]"
79 . 1 66 VAL C 1 67 ARG N 1 67 ARG CA 1 67 ARG C -75.10 -55.10 -57.02 -61.66 -63.77 5.20 3 1 "[ + . 1 . 2]"
80 . 1 67 ARG N 1 67 ARG CA 1 67 ARG C 1 68 ASP N -50.60 -30.60 -37.19 -50.47 -29.81 0.79 6 0 "[ . 1 . 2]"
81 . 1 67 ARG C 1 68 ASP N 1 68 ASP CA 1 68 ASP C -75.30 -55.30 -72.52 -78.79 -61.24 3.49 10 0 "[ . 1 . 2]"
82 . 1 68 ASP N 1 68 ASP CA 1 68 ASP C 1 69 ILE N -51.90 -31.10 -40.10 -47.47 -29.44 1.66 10 0 "[ . 1 . 2]"
83 . 1 68 ASP C 1 69 ILE N 1 69 ILE CA 1 69 ILE C -75.30 -55.30 -65.18 -68.09 -73.28 0.39 1 0 "[ . 1 . 2]"
84 . 1 69 ILE N 1 69 ILE CA 1 69 ILE C 1 70 VAL N -52.20 -32.20 -35.04 -42.11 -28.78 3.42 3 0 "[ . 1 . 2]"
85 . 1 69 ILE C 1 70 VAL N 1 70 VAL CA 1 70 VAL C -72.70 -52.70 -58.90 -72.39 -51.43 1.27 5 0 "[ . 1 . 2]"
86 . 1 70 VAL N 1 70 VAL CA 1 70 VAL C 1 71 GLU N -53.30 -33.30 -42.55 -35.90 -39.11 3.44 14 0 "[ . 1 . 2]"
87 . 1 70 VAL C 1 71 GLU N 1 71 GLU CA 1 71 GLU C -74.00 -54.00 -56.59 -60.82 -53.02 0.98 7 0 "[ . 1 . 2]"
88 . 1 71 GLU N 1 71 GLU CA 1 71 GLU C 1 72 TYR N -49.90 -29.90 -44.12 -35.09 -38.70 1.33 6 0 "[ . 1 . 2]"
89 . 1 71 GLU C 1 72 TYR N 1 72 TYR CA 1 72 TYR C -73.90 -53.90 -62.27 -74.07 -53.60 0.30 12 0 "[ . 1 . 2]"
90 . 1 72 TYR N 1 72 TYR CA 1 72 TYR C 1 73 ALA N -56.20 -36.20 -48.01 -47.79 -49.88 0.31 12 0 "[ . 1 . 2]"
91 . 1 72 TYR C 1 73 ALA N 1 73 ALA CA 1 73 ALA C -71.50 -51.50 -64.15 -72.30 -59.74 0.80 14 0 "[ . 1 . 2]"
92 . 1 73 ALA N 1 73 ALA CA 1 73 ALA C 1 74 GLN N -52.80 -32.80 -32.29 -28.44 -29.62 4.95 2 0 "[ . 1 . 2]"
93 . 1 73 ALA C 1 74 GLN N 1 74 GLN CA 1 74 GLN C -74.00 -54.00 -69.86 -71.20 -71.59 1.01 5 0 "[ . 1 . 2]"
94 . 1 74 GLN N 1 74 GLN CA 1 74 GLN C 1 75 LYS N -50.70 -30.30 -36.12 -38.04 -42.77 2.52 8 0 "[ . 1 . 2]"
95 . 1 79 ARG C 1 80 VAL N 1 80 VAL CA 1 80 VAL C -140.60 -107.60 -107.77 -121.15 -102.85 4.75 8 0 "[ . 1 . 2]"
96 . 1 80 VAL N 1 80 VAL CA 1 80 VAL C 1 81 LEU N 120.90 149.90 124.74 124.23 121.93 2.54 5 0 "[ . 1 . 2]"
97 . 1 80 VAL C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -135.50 -102.30 -136.20 -135.75 -135.98 3.92 3 0 "[ . 1 . 2]"
98 . 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 VAL N 111.20 144.20 109.46 106.46 121.44 4.74 7 0 "[ . 1 . 2]"
99 . 1 81 LEU C 1 82 VAL N 1 82 VAL CA 1 82 VAL C -130.20 -97.00 -99.23 -106.94 -95.09 1.91 1 0 "[ . 1 . 2]"
100 . 1 82 VAL N 1 82 VAL CA 1 82 VAL C 1 83 ILE N 115.80 137.60 115.05 109.93 127.49 5.87 13 1 "[ . 1 + . 2]"
101 . 1 82 VAL C 1 83 ILE N 1 83 ILE CA 1 83 ILE C -129.60 -101.20 -101.09 -109.98 -96.08 5.12 1 1 "[+ . 1 . 2]"
102 . 1 83 ILE N 1 83 ILE CA 1 83 ILE C 1 84 LYS N 111.40 135.00 109.87 104.95 122.20 6.45 3 3 "[ + .- 1 * . 2]"
103 . 1 83 ILE C 1 84 LYS N 1 84 LYS CA 1 84 LYS C -134.00 -97.00 -129.90 -137.69 -111.31 3.69 6 0 "[ . 1 . 2]"
104 . 1 84 LYS N 1 84 LYS CA 1 84 LYS C 1 85 VAL N 105.00 137.40 135.83 140.42 138.43 6.05 3 2 "[ + . - 1 . 2]"
105 . 1 84 LYS C 1 85 VAL N 1 85 VAL CA 1 85 VAL C -115.40 -87.00 -86.92 -84.39 -84.64 6.85 7 2 "[ - . + 1 . 2]"
106 . 1 85 VAL N 1 85 VAL CA 1 85 VAL C 1 86 ALA N 104.00 137.40 112.51 111.65 109.19 2.48 18 0 "[ . 1 . 2]"
107 . 1 89 GLN C 1 90 GLU N 1 90 GLU CA 1 90 GLU C -74.30 -54.30 -67.05 -76.27 -55.31 1.97 9 0 "[ . 1 . 2]"
108 . 1 90 GLU N 1 90 GLU CA 1 90 GLU C 1 91 LEU N -52.80 -32.80 -43.63 -58.25 -31.55 5.45 12 1 "[ . 1 + . 2]"
109 . 1 90 GLU C 1 91 LEU N 1 91 LEU CA 1 91 LEU C -76.10 -56.10 -64.73 -76.99 -55.41 0.89 2 0 "[ . 1 . 2]"
110 . 1 91 LEU N 1 91 LEU CA 1 91 LEU C 1 92 LEU N -51.60 -30.40 -35.75 -39.70 -41.86 3.99 13 0 "[ . 1 . 2]"
111 . 1 91 LEU C 1 92 LEU N 1 92 LEU CA 1 92 LEU C -78.60 -58.60 -62.91 -73.45 -53.31 5.29 9 1 "[ . +1 . 2]"
112 . 1 92 LEU N 1 92 LEU CA 1 92 LEU C 1 93 GLU N -45.80 -22.80 -37.52 -32.38 -36.71 2.04 20 0 "[ . 1 . 2]"
113 . 1 92 LEU C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -77.60 -57.60 -66.69 -72.26 -75.20 2.23 4 0 "[ . 1 . 2]"
114 . 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 ARG N -46.50 -25.30 -30.01 -35.00 -37.94 3.03 2 0 "[ . 1 . 2]"
115 . 1 93 GLU C 1 94 ARG N 1 94 ARG CA 1 94 ARG C -74.00 -47.00 -62.51 -70.20 -53.42 . . 0 "[ . 1 . 2]"
116 . 1 94 ARG N 1 94 ARG CA 1 94 ARG C 1 95 PHE N -50.00 -22.20 -49.38 -51.29 -51.66 3.58 18 0 "[ . 1 . 2]"
117 . 1 94 ARG C 1 95 PHE N 1 95 PHE CA 1 95 PHE C -77.20 -49.60 -70.75 -80.43 -59.86 3.23 6 0 "[ . 1 . 2]"
118 . 1 95 PHE N 1 95 PHE CA 1 95 PHE C 1 96 TYR N -53.00 -25.20 -41.88 -48.28 -33.78 . . 0 "[ . 1 . 2]"
119 . 1 95 PHE C 1 96 TYR N 1 96 TYR CA 1 96 TYR C -73.90 -53.30 -53.83 -58.40 -51.90 1.40 18 0 "[ . 1 . 2]"
120 . 1 96 TYR N 1 96 TYR CA 1 96 TYR C 1 97 GLU N -52.40 -32.40 -43.53 -53.15 -29.57 2.83 20 0 "[ . 1 . 2]"
121 . 1 96 TYR C 1 97 GLU N 1 97 GLU CA 1 97 GLU C -77.60 -57.60 -68.88 -78.40 -62.73 0.80 4 0 "[ . 1 . 2]"
122 . 1 97 GLU N 1 97 GLU CA 1 97 GLU C 1 98 GLN N -50.00 -24.80 -35.92 -29.43 -31.34 . . 0 "[ . 1 . 2]"
123 . 1 97 GLU C 1 98 GLN N 1 98 GLN CA 1 98 GLN C -74.90 -54.90 -59.31 -57.42 -58.38 0.29 17 0 "[ . 1 . 2]"
124 . 1 98 GLN N 1 98 GLN CA 1 98 GLN C 1 99 LEU N -50.90 -30.90 -42.00 -52.86 -29.89 1.96 11 0 "[ . 1 . 2]"
125 . 1 98 GLN C 1 99 LEU N 1 99 LEU CA 1 99 LEU C -75.00 -55.00 -66.58 -75.39 -57.10 0.39 10 0 "[ . 1 . 2]"
126 . 1 99 LEU N 1 99 LEU CA 1 99 LEU C 1 100 LYS N -51.30 -31.30 -40.36 -34.13 -40.64 2.32 8 0 "[ . 1 . 2]"
127 . 1 99 LEU C 1 100 LYS N 1 100 LYS CA 1 100 LYS C -75.00 -55.00 -69.20 -71.55 -74.50 1.20 20 0 "[ . 1 . 2]"
128 . 1 100 LYS N 1 100 LYS CA 1 100 LYS C 1 101 LYS N -49.30 -29.30 -31.30 -33.80 -37.26 1.90 14 0 "[ . 1 . 2]"
129 . 1 105 ASP C 1 106 VAL N 1 106 VAL CA 1 106 VAL C -134.40 -93.60 -116.97 -93.02 -116.66 2.59 5 0 "[ . 1 . 2]"
130 . 1 106 VAL N 1 106 VAL CA 1 106 VAL C 1 107 ARG N 119.10 141.10 130.91 135.18 131.68 3.57 12 0 "[ . 1 . 2]"
131 . 1 106 VAL C 1 107 ARG N 1 107 ARG CA 1 107 ARG C -134.90 -89.70 -110.24 -136.11 -86.26 3.44 10 0 "[ . 1 . 2]"
132 . 1 107 ARG N 1 107 ARG CA 1 107 ARG C 1 108 VAL N 110.70 150.10 112.30 127.59 112.46 5.78 15 3 "[ .- 1 + *]"
133 . 1 107 ARG C 1 108 VAL N 1 108 VAL CA 1 108 VAL C -122.60 -86.60 -94.85 -120.13 -83.00 3.60 5 0 "[ . 1 . 2]"
134 . 1 108 VAL N 1 108 VAL CA 1 108 VAL C 1 109 THR N 115.10 141.10 119.72 113.91 113.26 5.53 16 1 "[ . 1 .+ 2]"
135 . 1 112 GLU C 1 113 ASP N 1 113 ASP CA 1 113 ASP C -74.60 -54.60 -68.99 -75.93 -59.36 1.33 14 0 "[ . 1 . 2]"
136 . 1 113 ASP N 1 113 ASP CA 1 113 ASP C 1 114 GLU N -51.80 -31.80 -37.00 -32.07 -42.77 3.95 20 0 "[ . 1 . 2]"
137 . 1 113 ASP C 1 114 GLU N 1 114 GLU CA 1 114 GLU C -76.00 -56.00 -66.78 -68.52 -69.83 0.99 1 0 "[ . 1 . 2]"
138 . 1 114 GLU N 1 114 GLU CA 1 114 GLU C 1 115 ALA N -50.50 -30.50 -34.74 -44.86 -28.63 1.87 10 0 "[ . 1 . 2]"
139 . 1 114 GLU C 1 115 ALA N 1 115 ALA CA 1 115 ALA C -76.20 -56.20 -64.21 -72.84 -56.01 0.19 7 0 "[ . 1 . 2]"
140 . 1 115 ALA N 1 115 ALA CA 1 115 ALA C 1 116 LYS N -54.30 -34.30 -44.15 -48.34 -49.50 2.18 9 0 "[ . 1 . 2]"
141 . 1 115 ALA C 1 116 LYS N 1 116 LYS CA 1 116 LYS C -71.90 -51.90 -60.75 -73.82 -50.86 1.92 4 0 "[ . 1 . 2]"
142 . 1 116 LYS N 1 116 LYS CA 1 116 LYS C 1 117 LYS N -53.50 -33.50 -43.99 -33.62 -36.40 2.68 10 0 "[ . 1 . 2]"
143 . 1 116 LYS C 1 117 LYS N 1 117 LYS CA 1 117 LYS C -74.80 -54.80 -64.49 -60.31 -61.56 . . 0 "[ . 1 . 2]"
144 . 1 117 LYS N 1 117 LYS CA 1 117 LYS C 1 118 ARG N -53.70 -33.70 -43.83 -55.96 -30.90 2.80 14 0 "[ . 1 . 2]"
145 . 1 117 LYS C 1 118 ARG N 1 118 ARG CA 1 118 ARG C -75.50 -55.50 -65.81 -54.78 -57.51 0.83 11 0 "[ . 1 . 2]"
146 . 1 118 ARG N 1 118 ARG CA 1 118 ARG C 1 119 LEU N -49.10 -28.70 -35.60 -51.34 -23.16 5.54 10 1 "[ . + . 2]"
147 . 1 118 ARG C 1 119 LEU N 1 119 LEU CA 1 119 LEU C -74.80 -54.80 -59.52 -54.79 -55.85 1.84 15 0 "[ . 1 . 2]"
148 . 1 119 LEU N 1 119 LEU CA 1 119 LEU C 1 120 LYS N -53.10 -33.10 -51.02 -52.36 -53.24 2.41 10 0 "[ . 1 . 2]"
149 . 1 119 LEU C 1 120 LYS N 1 120 LYS CA 1 120 LYS C -72.90 -52.90 -62.90 -65.53 -67.51 . . 0 "[ . 1 . 2]"
150 . 1 120 LYS N 1 120 LYS CA 1 120 LYS C 1 121 GLU N -49.10 -29.10 -40.77 -48.90 -34.55 . . 0 "[ . 1 . 2]"
151 . 1 120 LYS C 1 121 GLU N 1 121 GLU CA 1 121 GLU C -74.30 -54.30 -60.22 -70.62 -52.26 2.04 10 0 "[ . 1 . 2]"
152 . 1 121 GLU N 1 121 GLU CA 1 121 GLU C 1 122 LEU N -52.80 -32.80 -42.21 -55.51 -28.90 3.90 15 0 "[ . 1 . 2]"
153 . 1 121 GLU C 1 122 LEU N 1 122 LEU CA 1 122 LEU C -76.10 -56.10 -70.10 -73.40 -76.37 3.39 10 0 "[ . 1 . 2]"
154 . 1 122 LEU N 1 122 LEU CA 1 122 LEU C 1 123 LEU N -51.60 -30.40 -38.00 -53.45 -25.59 4.81 6 0 "[ . 1 . 2]"
155 . 1 122 LEU C 1 123 LEU N 1 123 LEU CA 1 123 LEU C -78.60 -58.60 -64.95 -65.14 -67.44 0.30 5 0 "[ . 1 . 2]"
156 . 1 123 LEU N 1 123 LEU CA 1 123 LEU C 1 124 GLU N -45.80 -22.80 -34.93 -18.89 -21.27 3.91 2 0 "[ . 1 . 2]"
157 . 1 123 LEU C 1 124 GLU N 1 124 GLU CA 1 124 GLU C -77.60 -57.60 -64.34 -56.29 -57.77 1.31 2 0 "[ . 1 . 2]"
158 . 1 124 GLU N 1 124 GLU CA 1 124 GLU C 1 125 LYS N -46.50 -25.30 -28.75 -48.32 -23.73 1.82 12 0 "[ . 1 . 2]"
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