NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
593617 |
2rv8   |
11590 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2rv8
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 185
_TA_constraint_stats_list.Viol_count 240
_TA_constraint_stats_list.Viol_total 8768.61
_TA_constraint_stats_list.Viol_max 4.94
_TA_constraint_stats_list.Viol_rms 0.36
_TA_constraint_stats_list.Viol_average_all_restraints 0.05
_TA_constraint_stats_list.Viol_average_violations_only 1.22
_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 29 ASN C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -141.10 -1.10 -90.25 -86.69 -88.50 . . 0 "[ . 1 . 2 . 3]"
2 . 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 ARG N 68.70 -151.30 121.02 129.64 120.63 . . 0 "[ . 1 . 2 . 3]"
3 . 1 30 VAL C 1 31 ARG N 1 31 ARG CA 1 31 ARG C -173.60 -33.60 -139.11 -175.27 -104.81 1.67 17 0 "[ . 1 . 2 . 3]"
4 . 1 31 ARG N 1 31 ARG CA 1 31 ARG C 1 32 LEU N 75.30 -178.50 135.88 138.09 134.60 1.33 10 0 "[ . 1 . 2 . 3]"
5 . 1 31 ARG C 1 32 LEU N 1 32 LEU CA 1 32 LEU C -145.00 -82.20 -95.81 -91.37 -91.66 1.09 16 0 "[ . 1 . 2 . 3]"
6 . 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 33 THR N 108.60 168.60 151.10 150.77 149.43 . . 0 "[ . 1 . 2 . 3]"
7 . 1 32 LEU C 1 33 THR N 1 33 THR CA 1 33 THR C -152.70 -92.70 -141.03 -140.67 -141.00 . . 0 "[ . 1 . 2 . 3]"
8 . 1 33 THR N 1 33 THR CA 1 33 THR C 1 34 PHE N 111.30 171.30 156.66 156.66 156.19 . . 0 "[ . 1 . 2 . 3]"
9 . 1 33 THR C 1 34 PHE N 1 34 PHE CA 1 34 PHE C 178.90 -85.30 -164.14 -169.66 -156.86 . . 0 "[ . 1 . 2 . 3]"
10 . 1 34 PHE N 1 34 PHE CA 1 34 PHE C 1 35 ALA N 100.30 160.30 131.87 129.81 128.72 . . 0 "[ . 1 . 2 . 3]"
11 . 1 35 ALA C 1 36 ASP N 1 36 ASP CA 1 36 ASP C -123.80 -52.80 -123.71 -125.61 -98.63 1.81 6 0 "[ . 1 . 2 . 3]"
12 . 1 36 ASP N 1 36 ASP CA 1 36 ASP C 1 37 ILE N 57.30 -162.70 53.52 52.36 54.48 4.94 17 0 "[ . 1 . 2 . 3]"
13 . 1 36 ASP C 1 37 ILE N 1 37 ILE CA 1 37 ILE C -135.50 -75.50 -137.91 -138.85 -137.05 3.35 8 0 "[ . 1 . 2 . 3]"
14 . 1 37 ILE N 1 37 ILE CA 1 37 ILE C 1 38 GLU N 100.30 160.30 149.11 150.05 148.34 . . 0 "[ . 1 . 2 . 3]"
15 . 1 37 ILE C 1 38 GLU N 1 38 GLU CA 1 38 GLU C -153.10 -93.10 -142.34 -147.76 -134.42 . . 0 "[ . 1 . 2 . 3]"
16 . 1 38 GLU N 1 38 GLU CA 1 38 GLU C 1 39 LEU N 121.60 -178.40 140.51 140.12 138.68 . . 0 "[ . 1 . 2 . 3]"
17 . 1 38 GLU C 1 39 LEU N 1 39 LEU CA 1 39 LEU C -175.80 -88.20 -136.15 -136.59 -136.67 . . 0 "[ . 1 . 2 . 3]"
18 . 1 39 LEU N 1 39 LEU CA 1 39 LEU C 1 40 ASP N 112.60 172.60 132.28 116.88 152.20 . . 0 "[ . 1 . 2 . 3]"
19 . 1 39 LEU C 1 40 ASP N 1 40 ASP CA 1 40 ASP C -132.70 -63.50 -112.03 -131.15 -102.59 . . 0 "[ . 1 . 2 . 3]"
20 . 1 40 ASP N 1 40 ASP CA 1 40 ASP C 1 41 GLU N 92.80 -177.00 106.83 98.95 115.42 . . 0 "[ . 1 . 2 . 3]"
21 . 1 40 ASP C 1 41 GLU N 1 41 GLU CA 1 41 GLU C -86.80 -26.80 -66.25 -67.35 -64.95 . . 0 "[ . 1 . 2 . 3]"
22 . 1 41 GLU N 1 41 GLU CA 1 41 GLU C 1 42 GLU N -64.60 -4.60 -17.67 -45.07 -8.22 . . 0 "[ . 1 . 2 . 3]"
23 . 1 41 GLU C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -107.20 -47.20 -81.05 -72.64 -79.97 . . 0 "[ . 1 . 2 . 3]"
24 . 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 THR N -52.30 13.90 -45.87 -46.09 -47.18 0.28 14 0 "[ . 1 . 2 . 3]"
25 . 1 42 GLU C 1 43 THR N 1 43 THR CA 1 43 THR C -134.40 -54.80 -102.99 -129.29 -92.57 . . 0 "[ . 1 . 2 . 3]"
26 . 1 43 THR N 1 43 THR CA 1 43 THR C 1 44 HIS N -29.50 32.30 5.10 -25.39 14.88 . . 0 "[ . 1 . 2 . 3]"
27 . 1 43 THR C 1 44 HIS N 1 44 HIS CA 1 44 HIS C 28.00 88.00 44.02 82.14 38.52 . . 0 "[ . 1 . 2 . 3]"
28 . 1 44 HIS N 1 44 HIS CA 1 44 HIS C 1 45 GLU N 5.90 65.90 52.84 41.15 63.79 . . 0 "[ . 1 . 2 . 3]"
29 . 1 44 HIS C 1 45 GLU N 1 45 GLU CA 1 45 GLU C -171.00 -55.00 -124.65 -124.26 -126.85 . . 0 "[ . 1 . 2 . 3]"
30 . 1 45 GLU N 1 45 GLU CA 1 45 GLU C 1 46 VAL N 117.00 -175.00 157.86 150.90 169.36 . . 0 "[ . 1 . 2 . 3]"
31 . 1 45 GLU C 1 46 VAL N 1 46 VAL CA 1 46 VAL C -158.00 -94.20 -120.68 -122.51 -122.70 . . 0 "[ . 1 . 2 . 3]"
32 . 1 46 VAL N 1 46 VAL CA 1 46 VAL C 1 47 TRP N 111.70 171.70 154.06 149.60 148.77 . . 0 "[ . 1 . 2 . 3]"
33 . 1 46 VAL C 1 47 TRP N 1 47 TRP CA 1 47 TRP C -159.90 -99.90 -146.08 -145.83 -145.99 . . 0 "[ . 1 . 2 . 3]"
34 . 1 47 TRP N 1 47 TRP CA 1 47 TRP C 1 48 LYS N 102.40 176.00 126.49 128.20 127.76 . . 0 "[ . 1 . 2 . 3]"
35 . 1 47 TRP C 1 48 LYS N 1 48 LYS CA 1 48 LYS C -170.80 -88.20 -126.66 -128.08 -128.64 . . 0 "[ . 1 . 2 . 3]"
36 . 1 48 LYS N 1 48 LYS CA 1 48 LYS C 1 49 ALA N 95.00 155.00 113.33 105.12 121.13 . . 0 "[ . 1 . 2 . 3]"
37 . 1 48 LYS C 1 49 ALA N 1 49 ALA CA 1 49 ALA C 24.50 84.50 31.29 30.93 30.83 . . 0 "[ . 1 . 2 . 3]"
38 . 1 49 ALA N 1 49 ALA CA 1 49 ALA C 1 50 GLY N 10.90 70.90 64.43 67.01 65.06 1.07 18 0 "[ . 1 . 2 . 3]"
39 . 1 49 ALA C 1 50 GLY N 1 50 GLY CA 1 50 GLY C 46.30 106.30 61.66 53.03 71.79 . . 0 "[ . 1 . 2 . 3]"
40 . 1 50 GLY N 1 50 GLY CA 1 50 GLY C 1 51 GLN N -25.20 34.80 28.11 21.83 34.69 . . 0 "[ . 1 . 2 . 3]"
41 . 1 50 GLY C 1 51 GLN N 1 51 GLN CA 1 51 GLN C -141.70 -63.70 -134.20 -142.37 -129.02 0.67 24 0 "[ . 1 . 2 . 3]"
42 . 1 51 GLN N 1 51 GLN CA 1 51 GLN C 1 52 PRO N 84.80 171.20 93.51 93.28 92.93 . . 0 "[ . 1 . 2 . 3]"
43 . 1 51 GLN C 1 52 PRO N 1 52 PRO CA 1 52 PRO C -98.90 -38.90 -75.76 -77.56 -78.27 . . 0 "[ . 1 . 2 . 3]"
44 . 1 52 PRO N 1 52 PRO CA 1 52 PRO C 1 53 VAL N 118.40 178.40 139.31 132.00 154.07 . . 0 "[ . 1 . 2 . 3]"
45 . 1 52 PRO C 1 53 VAL N 1 53 VAL CA 1 53 VAL C -151.80 -86.80 -127.71 -125.88 -126.50 . . 0 "[ . 1 . 2 . 3]"
46 . 1 53 VAL N 1 53 VAL CA 1 53 VAL C 1 54 SER N 102.60 162.60 137.85 134.99 132.27 . . 0 "[ . 1 . 2 . 3]"
47 . 1 53 VAL C 1 54 SER N 1 54 SER CA 1 54 SER C -135.20 -75.20 -92.07 -99.47 -81.76 . . 0 "[ . 1 . 2 . 3]"
48 . 1 54 SER N 1 54 SER CA 1 54 SER C 1 55 LEU N 87.70 147.70 98.20 86.95 138.86 0.75 4 0 "[ . 1 . 2 . 3]"
49 . 1 54 SER C 1 55 LEU N 1 55 LEU CA 1 55 LEU C -144.90 -75.50 -104.35 -142.85 -93.92 . . 0 "[ . 1 . 2 . 3]"
50 . 1 55 LEU N 1 55 LEU CA 1 55 LEU C 1 56 SER N 90.80 155.60 146.11 97.16 156.04 0.44 20 0 "[ . 1 . 2 . 3]"
51 . 1 55 LEU C 1 56 SER N 1 56 SER CA 1 56 SER C -132.90 -33.10 -76.83 -74.87 -78.88 . . 0 "[ . 1 . 2 . 3]"
52 . 1 56 SER N 1 56 SER CA 1 56 SER C 1 57 PRO N 101.00 -170.60 170.05 170.51 169.85 . . 0 "[ . 1 . 2 . 3]"
53 . 1 56 SER C 1 57 PRO N 1 57 PRO CA 1 57 PRO C -84.10 -24.10 -49.98 -67.60 -42.12 . . 0 "[ . 1 . 2 . 3]"
54 . 1 57 PRO N 1 57 PRO CA 1 57 PRO C 1 58 THR N -67.00 -7.00 -51.24 -53.49 -53.72 . . 0 "[ . 1 . 2 . 3]"
55 . 1 57 PRO C 1 58 THR N 1 58 THR CA 1 58 THR C -96.90 -36.90 -55.80 -56.30 -57.46 . . 0 "[ . 1 . 2 . 3]"
56 . 1 58 THR N 1 58 THR CA 1 58 THR C 1 59 GLU N -66.20 -6.20 -54.99 -56.42 -56.60 . . 0 "[ . 1 . 2 . 3]"
57 . 1 58 THR C 1 59 GLU N 1 59 GLU CA 1 59 GLU C -93.60 -33.60 -60.54 -66.43 -55.77 . . 0 "[ . 1 . 2 . 3]"
58 . 1 59 GLU N 1 59 GLU CA 1 59 GLU C 1 60 PHE N -74.20 -14.20 -38.45 -45.00 -33.34 . . 0 "[ . 1 . 2 . 3]"
59 . 1 59 GLU C 1 60 PHE N 1 60 PHE CA 1 60 PHE C -91.00 -31.00 -61.10 -64.71 -65.71 . . 0 "[ . 1 . 2 . 3]"
60 . 1 60 PHE N 1 60 PHE CA 1 60 PHE C 1 61 THR N -72.80 -12.80 -47.25 -52.79 -42.42 . . 0 "[ . 1 . 2 . 3]"
61 . 1 60 PHE C 1 61 THR N 1 61 THR CA 1 61 THR C -93.60 -33.60 -59.25 -58.66 -58.80 . . 0 "[ . 1 . 2 . 3]"
62 . 1 61 THR N 1 61 THR CA 1 61 THR C 1 62 LEU N -72.40 -12.40 -42.60 -48.02 -35.69 . . 0 "[ . 1 . 2 . 3]"
63 . 1 61 THR C 1 62 LEU N 1 62 LEU CA 1 62 LEU C -96.10 -36.10 -59.72 -58.55 -58.81 . . 0 "[ . 1 . 2 . 3]"
64 . 1 62 LEU N 1 62 LEU CA 1 62 LEU C 1 63 LEU N -73.80 -13.80 -47.88 -51.61 -52.53 . . 0 "[ . 1 . 2 . 3]"
65 . 1 62 LEU C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -92.10 -32.10 -63.63 -71.36 -57.95 . . 0 "[ . 1 . 2 . 3]"
66 . 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 ARG N -73.60 -13.60 -42.72 -40.65 -41.09 . . 0 "[ . 1 . 2 . 3]"
67 . 1 63 LEU C 1 64 ARG N 1 64 ARG CA 1 64 ARG C -90.80 -30.80 -58.99 -59.31 -59.58 . . 0 "[ . 1 . 2 . 3]"
68 . 1 64 ARG N 1 64 ARG CA 1 64 ARG C 1 65 TYR N -73.80 -13.80 -44.76 -45.84 -46.36 . . 0 "[ . 1 . 2 . 3]"
69 . 1 64 ARG C 1 65 TYR N 1 65 TYR CA 1 65 TYR C -93.80 -33.80 -64.83 -69.83 -59.25 . . 0 "[ . 1 . 2 . 3]"
70 . 1 65 TYR N 1 65 TYR CA 1 65 TYR C 1 66 PHE N -70.70 -10.70 -41.77 -39.85 -40.35 . . 0 "[ . 1 . 2 . 3]"
71 . 1 65 TYR C 1 66 PHE N 1 66 PHE CA 1 66 PHE C -94.20 -34.20 -57.32 -62.83 -52.43 . . 0 "[ . 1 . 2 . 3]"
72 . 1 66 PHE N 1 66 PHE CA 1 66 PHE C 1 67 VAL N -68.60 -8.60 -43.52 -42.03 -42.84 . . 0 "[ . 1 . 2 . 3]"
73 . 1 66 PHE C 1 67 VAL N 1 67 VAL CA 1 67 VAL C -93.40 -33.40 -65.99 -72.87 -57.68 . . 0 "[ . 1 . 2 . 3]"
74 . 1 67 VAL N 1 67 VAL CA 1 67 VAL C 1 68 ILE N -73.60 -13.60 -47.35 -45.35 -45.45 . . 0 "[ . 1 . 2 . 3]"
75 . 1 67 VAL C 1 68 ILE N 1 68 ILE CA 1 68 ILE C -97.20 -37.20 -57.95 -65.71 -50.88 . . 0 "[ . 1 . 2 . 3]"
76 . 1 68 ILE N 1 68 ILE CA 1 68 ILE C 1 69 ASN N -59.90 0.10 -34.14 -34.67 -35.58 . . 0 "[ . 1 . 2 . 3]"
77 . 1 68 ILE C 1 69 ASN N 1 69 ASN CA 1 69 ASN C -132.50 -72.50 -108.18 -113.99 -104.30 . . 0 "[ . 1 . 2 . 3]"
78 . 1 69 ASN N 1 69 ASN CA 1 69 ASN C 1 70 ALA N -29.90 30.10 23.24 15.23 28.80 . . 0 "[ . 1 . 2 . 3]"
79 . 1 69 ASN C 1 70 ALA N 1 70 ALA CA 1 70 ALA C -92.20 -32.20 -54.47 -53.57 -54.02 . . 0 "[ . 1 . 2 . 3]"
80 . 1 70 ALA N 1 70 ALA CA 1 70 ALA C 1 71 GLY N 105.50 165.50 118.76 109.78 125.87 . . 0 "[ . 1 . 2 . 3]"
81 . 1 70 ALA C 1 71 GLY N 1 71 GLY CA 1 71 GLY C 56.80 116.80 110.32 98.83 116.90 0.10 11 0 "[ . 1 . 2 . 3]"
82 . 1 71 GLY N 1 71 GLY CA 1 71 GLY C 1 72 THR N -38.20 21.80 -23.18 -21.42 -22.49 . . 0 "[ . 1 . 2 . 3]"
83 . 1 71 GLY C 1 72 THR N 1 72 THR CA 1 72 THR C -139.00 -41.80 -93.77 -95.29 -95.46 . . 0 "[ . 1 . 2 . 3]"
84 . 1 72 THR N 1 72 THR CA 1 72 THR C 1 73 VAL N 99.90 168.10 129.45 122.45 135.26 . . 0 "[ . 1 . 2 . 3]"
85 . 1 72 THR C 1 73 VAL N 1 73 VAL CA 1 73 VAL C -132.10 -50.50 -68.38 -69.44 -66.96 . . 0 "[ . 1 . 2 . 3]"
86 . 1 73 VAL N 1 73 VAL CA 1 73 VAL C 1 74 LEU N 91.40 151.40 118.55 112.91 126.29 . . 0 "[ . 1 . 2 . 3]"
87 . 1 73 VAL C 1 74 LEU N 1 74 LEU CA 1 74 LEU C -146.30 -66.90 -96.49 -97.89 -94.50 . . 0 "[ . 1 . 2 . 3]"
88 . 1 74 LEU N 1 74 LEU CA 1 74 LEU C 1 75 SER N 86.70 168.90 158.34 149.14 168.84 . . 0 "[ . 1 . 2 . 3]"
89 . 1 74 LEU C 1 75 SER N 1 75 SER CA 1 75 SER C -163.40 -50.60 -107.69 -110.24 -110.66 . . 0 "[ . 1 . 2 . 3]"
90 . 1 75 SER N 1 75 SER CA 1 75 SER C 1 76 LYS N 148.90 -151.10 148.42 147.25 151.11 1.65 22 0 "[ . 1 . 2 . 3]"
91 . 1 75 SER C 1 76 LYS N 1 76 LYS CA 1 76 LYS C -88.90 -28.90 -57.10 -58.94 -55.03 . . 0 "[ . 1 . 2 . 3]"
92 . 1 76 LYS N 1 76 LYS CA 1 76 LYS C 1 77 PRO N -75.30 -15.30 -52.45 -46.69 -48.78 . . 0 "[ . 1 . 2 . 3]"
93 . 1 76 LYS C 1 77 PRO N 1 77 PRO CA 1 77 PRO C -88.30 -28.30 -63.62 -55.11 -62.84 . . 0 "[ . 1 . 2 . 3]"
94 . 1 77 PRO N 1 77 PRO CA 1 77 PRO C 1 78 LYS N -66.30 -6.30 -36.69 -52.41 -28.80 . . 0 "[ . 1 . 2 . 3]"
95 . 1 77 PRO C 1 78 LYS N 1 78 LYS CA 1 78 LYS C -95.10 -35.10 -65.12 -70.18 -57.04 . . 0 "[ . 1 . 2 . 3]"
96 . 1 78 LYS N 1 78 LYS CA 1 78 LYS C 1 79 ILE N -67.40 -7.40 -51.08 -59.93 -44.83 . . 0 "[ . 1 . 2 . 3]"
97 . 1 78 LYS C 1 79 ILE N 1 79 ILE CA 1 79 ILE C -94.80 -34.80 -54.46 -50.63 -52.05 . . 0 "[ . 1 . 2 . 3]"
98 . 1 79 ILE N 1 79 ILE CA 1 79 ILE C 1 80 LEU N -71.30 -11.30 -40.49 -44.96 -36.24 . . 0 "[ . 1 . 2 . 3]"
99 . 1 79 ILE C 1 80 LEU N 1 80 LEU CA 1 80 LEU C -89.40 -29.40 -60.96 -66.19 -56.66 . . 0 "[ . 1 . 2 . 3]"
100 . 1 80 LEU N 1 80 LEU CA 1 80 LEU C 1 81 ASP N -70.80 -10.80 -64.00 -70.61 -50.30 . . 0 "[ . 1 . 2 . 3]"
101 . 1 80 LEU C 1 81 ASP N 1 81 ASP CA 1 81 ASP C -95.90 -35.90 -54.14 -51.89 -52.18 . . 0 "[ . 1 . 2 . 3]"
102 . 1 81 ASP N 1 81 ASP CA 1 81 ASP C 1 82 HIS N -68.40 -8.40 -26.05 -38.91 -15.90 . . 0 "[ . 1 . 2 . 3]"
103 . 1 81 ASP C 1 82 HIS N 1 82 HIS CA 1 82 HIS C -106.80 -40.00 -71.93 -73.90 -70.84 . . 0 "[ . 1 . 2 . 3]"
104 . 1 82 HIS N 1 82 HIS CA 1 82 HIS C 1 83 VAL N -59.20 0.80 -51.87 -60.09 -41.79 0.89 15 0 "[ . 1 . 2 . 3]"
105 . 1 82 HIS C 1 83 VAL N 1 83 VAL CA 1 83 VAL C -98.40 -38.40 -83.88 -83.42 -83.50 . . 0 "[ . 1 . 2 . 3]"
106 . 1 83 VAL N 1 83 VAL CA 1 83 VAL C 1 84 TRP N -61.60 -1.60 -57.03 -62.17 -30.66 0.57 12 0 "[ . 1 . 2 . 3]"
107 . 1 83 VAL C 1 84 TRP N 1 84 TRP CA 1 84 TRP C -91.70 -31.70 -54.24 -67.29 -48.27 . . 0 "[ . 1 . 2 . 3]"
108 . 1 84 TRP N 1 84 TRP CA 1 84 TRP C 1 85 ARG N -63.40 -3.40 -4.10 -5.72 -6.30 1.22 21 0 "[ . 1 . 2 . 3]"
109 . 1 84 TRP C 1 85 ARG N 1 85 ARG CA 1 85 ARG C -100.90 -40.90 -58.94 -67.08 -40.97 . . 0 "[ . 1 . 2 . 3]"
110 . 1 85 ARG N 1 85 ARG CA 1 85 ARG C 1 86 TYR N -59.90 0.10 -3.96 -5.01 -6.44 0.76 23 0 "[ . 1 . 2 . 3]"
111 . 1 85 ARG C 1 86 TYR N 1 86 TYR CA 1 86 TYR C -131.70 -71.70 -115.47 -132.02 -98.50 0.32 2 0 "[ . 1 . 2 . 3]"
112 . 1 86 TYR N 1 86 TYR CA 1 86 TYR C 1 87 ASP N -32.00 28.00 13.14 13.18 11.95 0.09 2 0 "[ . 1 . 2 . 3]"
113 . 1 87 ASP C 1 88 PHE N 1 88 PHE CA 1 88 PHE C -140.50 -0.50 -72.58 -53.84 -67.83 . . 0 "[ . 1 . 2 . 3]"
114 . 1 88 PHE N 1 88 PHE CA 1 88 PHE C 1 89 GLY N 104.00 172.20 132.76 159.99 149.34 0.13 28 0 "[ . 1 . 2 . 3]"
115 . 1 89 GLY C 1 90 GLY N 1 90 GLY CA 1 90 GLY C -160.10 -20.10 -150.64 -159.06 -159.59 1.01 26 0 "[ . 1 . 2 . 3]"
116 . 1 90 GLY N 1 90 GLY CA 1 90 GLY C 1 91 ASP N 60.30 -159.70 95.73 59.04 -157.01 2.69 24 0 "[ . 1 . 2 . 3]"
117 . 1 90 GLY C 1 91 ASP N 1 91 ASP CA 1 91 ASP C -148.90 -43.70 -69.69 -148.81 -43.09 0.61 26 0 "[ . 1 . 2 . 3]"
118 . 1 91 ASP N 1 91 ASP CA 1 91 ASP C 1 92 VAL N 94.20 -174.00 158.32 94.53 -173.31 0.69 22 0 "[ . 1 . 2 . 3]"
119 . 1 91 ASP C 1 92 VAL N 1 92 VAL CA 1 92 VAL C -89.40 -29.40 -80.11 -72.02 -77.49 . . 0 "[ . 1 . 2 . 3]"
120 . 1 92 VAL N 1 92 VAL CA 1 92 VAL C 1 93 ASN N -61.90 9.70 -6.60 -9.03 -9.60 . . 0 "[ . 1 . 2 . 3]"
121 . 1 92 VAL C 1 93 ASN N 1 93 ASN CA 1 93 ASN C -99.80 -39.40 -89.06 -100.17 -73.00 0.37 14 0 "[ . 1 . 2 . 3]"
122 . 1 93 ASN N 1 93 ASN CA 1 93 ASN C 1 94 VAL N -84.60 17.80 -23.93 -70.56 -12.41 . . 0 "[ . 1 . 2 . 3]"
123 . 1 93 ASN C 1 94 VAL N 1 94 VAL CA 1 94 VAL C -105.40 -31.40 -64.44 -68.90 -34.61 . . 0 "[ . 1 . 2 . 3]"
124 . 1 94 VAL N 1 94 VAL CA 1 94 VAL C 1 95 VAL N -73.70 -13.70 -38.07 -46.34 -31.41 . . 0 "[ . 1 . 2 . 3]"
125 . 1 94 VAL C 1 95 VAL N 1 95 VAL CA 1 95 VAL C -91.20 -31.20 -59.27 -59.20 -59.70 . . 0 "[ . 1 . 2 . 3]"
126 . 1 95 VAL N 1 95 VAL CA 1 95 VAL C 1 96 GLU N -76.20 -16.20 -49.26 -56.20 -43.05 . . 0 "[ . 1 . 2 . 3]"
127 . 1 95 VAL C 1 96 GLU N 1 96 GLU CA 1 96 GLU C -90.20 -30.20 -56.74 -61.45 -52.63 . . 0 "[ . 1 . 2 . 3]"
128 . 1 96 GLU N 1 96 GLU CA 1 96 GLU C 1 97 SER N -69.40 -9.40 -46.91 -49.56 -43.83 . . 0 "[ . 1 . 2 . 3]"
129 . 1 96 GLU C 1 97 SER N 1 97 SER CA 1 97 SER C -93.80 -33.80 -60.61 -61.80 -58.07 . . 0 "[ . 1 . 2 . 3]"
130 . 1 97 SER N 1 97 SER CA 1 97 SER C 1 98 TYR N -73.40 -13.40 -45.62 -45.35 -45.66 . . 0 "[ . 1 . 2 . 3]"
131 . 1 97 SER C 1 98 TYR N 1 98 TYR CA 1 98 TYR C -95.90 -35.90 -63.53 -70.01 -57.38 . . 0 "[ . 1 . 2 . 3]"
132 . 1 98 TYR N 1 98 TYR CA 1 98 TYR C 1 99 VAL N -71.40 -11.40 -40.75 -45.34 -37.26 . . 0 "[ . 1 . 2 . 3]"
133 . 1 98 TYR C 1 99 VAL N 1 99 VAL CA 1 99 VAL C -93.70 -33.70 -62.35 -63.00 -63.54 . . 0 "[ . 1 . 2 . 3]"
134 . 1 99 VAL N 1 99 VAL CA 1 99 VAL C 1 100 SER N -71.20 -11.20 -42.42 -42.75 -43.11 . . 0 "[ . 1 . 2 . 3]"
135 . 1 99 VAL C 1 100 SER N 1 100 SER CA 1 100 SER C -90.90 -30.90 -63.77 -68.34 -59.13 . . 0 "[ . 1 . 2 . 3]"
136 . 1 100 SER N 1 100 SER CA 1 100 SER C 1 101 TYR N -71.80 -11.80 -44.43 -44.87 -45.15 . . 0 "[ . 1 . 2 . 3]"
137 . 1 100 SER C 1 101 TYR N 1 101 TYR CA 1 101 TYR C -97.90 -37.90 -68.42 -72.77 -63.42 . . 0 "[ . 1 . 2 . 3]"
138 . 1 101 TYR N 1 101 TYR CA 1 101 TYR C 1 102 LEU N -70.60 -10.60 -25.91 -33.45 -36.87 0.43 18 0 "[ . 1 . 2 . 3]"
139 . 1 101 TYR C 1 102 LEU N 1 102 LEU CA 1 102 LEU C -91.70 -31.70 -73.86 -87.40 -60.91 . . 0 "[ . 1 . 2 . 3]"
140 . 1 102 LEU N 1 102 LEU CA 1 102 LEU C 1 103 ARG N -68.90 -8.90 -47.13 -57.09 -42.34 . . 0 "[ . 1 . 2 . 3]"
141 . 1 102 LEU C 1 103 ARG N 1 103 ARG CA 1 103 ARG C -91.60 -31.60 -56.30 -59.22 -54.89 . . 0 "[ . 1 . 2 . 3]"
142 . 1 103 ARG N 1 103 ARG CA 1 103 ARG C 1 104 ARG N -70.10 -10.10 -44.99 -51.32 -37.85 . . 0 "[ . 1 . 2 . 3]"
143 . 1 103 ARG C 1 104 ARG N 1 104 ARG CA 1 104 ARG C -107.50 -47.50 -67.38 -69.00 -66.08 . . 0 "[ . 1 . 2 . 3]"
144 . 1 104 ARG N 1 104 ARG CA 1 104 ARG C 1 105 LYS N -66.50 3.50 -16.81 -26.36 -29.15 . . 0 "[ . 1 . 2 . 3]"
145 . 1 104 ARG C 1 105 LYS N 1 105 LYS CA 1 105 LYS C -113.00 -49.00 -93.17 -96.19 -90.58 . . 0 "[ . 1 . 2 . 3]"
146 . 1 105 LYS N 1 105 LYS CA 1 105 LYS C 1 106 ILE N -59.00 5.00 -31.17 -46.06 -11.26 . . 0 "[ . 1 . 2 . 3]"
147 . 1 105 LYS C 1 106 ILE N 1 106 ILE CA 1 106 ILE C -128.00 -68.00 -115.01 -113.28 -114.85 . . 0 "[ . 1 . 2 . 3]"
148 . 1 106 ILE N 1 106 ILE CA 1 106 ILE C 1 107 ASP N -122.00 18.00 -31.72 -45.49 -7.63 . . 0 "[ . 1 . 2 . 3]"
149 . 1 106 ILE C 1 107 ASP N 1 107 ASP CA 1 107 ASP C 175.20 -44.80 -100.34 -116.09 -91.57 . . 0 "[ . 1 . 2 . 3]"
150 . 1 107 ASP N 1 107 ASP CA 1 107 ASP C 1 108 THR N 137.40 -152.40 145.16 137.30 137.10 1.69 19 0 "[ . 1 . 2 . 3]"
151 . 1 108 THR C 1 109 GLY N 1 109 GLY CA 1 109 GLY C 175.20 -44.80 -90.03 -145.34 -46.01 . . 0 "[ . 1 . 2 . 3]"
152 . 1 109 GLY N 1 109 GLY CA 1 109 GLY C 1 110 GLU N 99.00 -135.40 174.35 179.87 174.30 . . 0 "[ . 1 . 2 . 3]"
153 . 1 109 GLY C 1 110 GLU N 1 110 GLU CA 1 110 GLU C -110.40 -41.00 -73.06 -74.66 -75.54 . . 0 "[ . 1 . 2 . 3]"
154 . 1 110 GLU N 1 110 GLU CA 1 110 GLU C 1 111 LYS N -56.30 3.70 -11.53 -44.74 -3.17 . . 0 "[ . 1 . 2 . 3]"
155 . 1 110 GLU C 1 111 LYS N 1 111 LYS CA 1 111 LYS C 167.00 -57.00 -93.08 -92.75 -92.86 . . 0 "[ . 1 . 2 . 3]"
156 . 1 111 LYS N 1 111 LYS CA 1 111 LYS C 1 112 ARG N 105.00 177.00 116.48 111.78 111.03 1.00 27 0 "[ . 1 . 2 . 3]"
157 . 1 111 LYS C 1 112 ARG N 1 112 ARG CA 1 112 ARG C -127.20 -67.20 -87.19 -87.60 -88.75 . . 0 "[ . 1 . 2 . 3]"
158 . 1 112 ARG N 1 112 ARG CA 1 112 ARG C 1 113 LEU N 88.10 160.10 127.23 125.86 114.03 0.06 14 0 "[ . 1 . 2 . 3]"
159 . 1 112 ARG C 1 113 LEU N 1 113 LEU CA 1 113 LEU C -146.40 -65.40 -108.40 -89.08 -89.44 1.15 22 0 "[ . 1 . 2 . 3]"
160 . 1 113 LEU C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -132.10 -72.10 -109.85 -105.54 -112.72 . . 0 "[ . 1 . 2 . 3]"
161 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C 1 115 HIS N 90.00 150.00 116.42 145.45 127.25 . . 0 "[ . 1 . 2 . 3]"
162 . 1 114 LEU C 1 115 HIS N 1 115 HIS CA 1 115 HIS C -148.00 -88.00 -97.42 -113.78 -87.57 0.43 12 0 "[ . 1 . 2 . 3]"
163 . 1 115 HIS N 1 115 HIS CA 1 115 HIS C 1 116 THR N 100.10 160.10 127.78 136.12 132.48 . . 0 "[ . 1 . 2 . 3]"
164 . 1 115 HIS C 1 116 THR N 1 116 THR CA 1 116 THR C -132.80 -71.60 -93.91 -97.63 -100.91 . . 0 "[ . 1 . 2 . 3]"
165 . 1 116 THR N 1 116 THR CA 1 116 THR C 1 117 LEU N 91.90 151.90 112.02 105.88 118.41 . . 0 "[ . 1 . 2 . 3]"
166 . 1 116 THR C 1 117 LEU N 1 117 LEU CA 1 117 LEU C -126.40 -66.40 -95.78 -97.07 -98.07 . . 0 "[ . 1 . 2 . 3]"
167 . 1 117 LEU N 1 117 LEU CA 1 117 LEU C 1 118 ARG N 68.10 -173.10 70.95 70.54 70.12 0.34 8 0 "[ . 1 . 2 . 3]"
168 . 1 117 LEU C 1 118 ARG N 1 118 ARG CA 1 118 ARG C -163.30 -23.30 -38.39 -45.14 -33.94 . . 0 "[ . 1 . 2 . 3]"
169 . 1 118 ARG N 1 118 ARG CA 1 118 ARG C 1 119 GLY N 93.20 171.40 123.03 96.16 142.18 . . 0 "[ . 1 . 2 . 3]"
170 . 1 119 GLY C 1 120 VAL N 1 120 VAL CA 1 120 VAL C -133.00 -57.40 -126.73 -133.41 -106.10 0.41 16 0 "[ . 1 . 2 . 3]"
171 . 1 120 VAL N 1 120 VAL CA 1 120 VAL C 1 121 GLY N -62.00 18.60 -53.28 -53.14 -54.60 . . 0 "[ . 1 . 2 . 3]"
172 . 1 120 VAL C 1 121 GLY N 1 121 GLY CA 1 121 GLY C 109.00 -111.00 155.85 135.96 165.19 . . 0 "[ . 1 . 2 . 3]"
173 . 1 121 GLY N 1 121 GLY CA 1 121 GLY C 1 122 TYR N 105.00 -137.60 -138.56 -138.21 -138.83 1.57 13 0 "[ . 1 . 2 . 3]"
174 . 1 121 GLY C 1 122 TYR N 1 122 TYR CA 1 122 TYR C -174.30 -101.70 -129.46 -131.48 -131.89 . . 0 "[ . 1 . 2 . 3]"
175 . 1 122 TYR N 1 122 TYR CA 1 122 TYR C 1 123 VAL N 129.10 -170.90 155.58 156.28 155.66 . . 0 "[ . 1 . 2 . 3]"
176 . 1 122 TYR C 1 123 VAL N 1 123 VAL CA 1 123 VAL C -165.40 -105.40 -138.09 -136.03 -136.62 . . 0 "[ . 1 . 2 . 3]"
177 . 1 123 VAL N 1 123 VAL CA 1 123 VAL C 1 124 LEU N 106.60 166.60 134.63 126.87 142.40 . . 0 "[ . 1 . 2 . 3]"
178 . 1 123 VAL C 1 124 LEU N 1 124 LEU CA 1 124 LEU C -148.20 -86.80 -91.57 -93.41 -89.91 . . 0 "[ . 1 . 2 . 3]"
179 . 1 124 LEU N 1 124 LEU CA 1 124 LEU C 1 125 ARG N 100.20 160.20 122.73 104.64 143.36 . . 0 "[ . 1 . 2 . 3]"
180 . 1 124 LEU C 1 125 ARG N 1 125 ARG CA 1 125 ARG C -163.30 -76.10 -162.39 -163.61 -161.26 0.31 26 0 "[ . 1 . 2 . 3]"
181 . 1 125 ARG N 1 125 ARG CA 1 125 ARG C 1 126 GLU N 100.90 174.30 133.34 115.75 153.48 . . 0 "[ . 1 . 2 . 3]"
182 . 1 125 ARG C 1 126 GLU N 1 126 GLU CA 1 126 GLU C -140.90 -40.70 -72.29 -63.74 -65.91 . . 0 "[ . 1 . 2 . 3]"
183 . 1 126 GLU N 1 126 GLU CA 1 126 GLU C 1 127 PRO N 64.90 -172.30 154.86 149.40 158.44 . . 0 "[ . 1 . 2 . 3]"
184 . 1 126 GLU C 1 127 PRO N 1 127 PRO CA 1 127 PRO C -92.60 -32.60 -55.37 -72.22 -36.57 . . 0 "[ . 1 . 2 . 3]"
185 . 1 127 PRO N 1 127 PRO CA 1 127 PRO C 1 128 ARG N 94.10 -173.70 127.68 101.81 169.19 . . 0 "[ . 1 . 2 . 3]"
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