NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
617702 |
5us5   |
30245 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5us5
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 214
_TA_constraint_stats_list.Viol_count 987
_TA_constraint_stats_list.Viol_total 16559.72
_TA_constraint_stats_list.Viol_max 4.44
_TA_constraint_stats_list.Viol_rms 0.49
_TA_constraint_stats_list.Viol_average_all_restraints 0.19
_TA_constraint_stats_list.Viol_average_violations_only 0.84
_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 PHI 1 18 LYS C 1 19 ALA N 1 19 ALA CA 1 19 ALA C -73.00 -53.00 -64.80 -73.75 -55.13 0.75 19 0 "[ . 1 . 2]"
2 PSI 1 19 ALA N 1 19 ALA CA 1 19 ALA C 1 20 ILE N -48.00 -28.00 -35.61 -48.82 -26.30 1.70 14 0 "[ . 1 . 2]"
3 PHI 1 19 ALA C 1 20 ILE N 1 20 ILE CA 1 20 ILE C -73.00 -53.00 -63.26 -69.91 -55.28 . . 0 "[ . 1 . 2]"
4 PSI 1 20 ILE N 1 20 ILE CA 1 20 ILE C 1 21 SER N -53.00 -33.00 -33.88 -37.84 -31.19 1.81 15 0 "[ . 1 . 2]"
5 PHI 1 20 ILE C 1 21 SER N 1 21 SER CA 1 21 SER C -75.00 -55.00 -69.14 -75.37 -60.93 0.37 5 0 "[ . 1 . 2]"
6 PSI 1 21 SER N 1 21 SER CA 1 21 SER C 1 22 GLU N -51.00 -31.00 -39.04 -50.65 -30.84 0.16 17 0 "[ . 1 . 2]"
7 PHI 1 21 SER C 1 22 GLU N 1 22 GLU CA 1 22 GLU C -75.00 -55.00 -65.83 -70.56 -75.11 0.64 19 0 "[ . 1 . 2]"
8 PSI 1 22 GLU N 1 22 GLU CA 1 22 GLU C 1 23 THR N -48.00 -28.00 -41.66 -49.22 -32.23 1.22 10 0 "[ . 1 . 2]"
9 PHI 1 22 GLU C 1 23 THR N 1 23 THR CA 1 23 THR C -75.00 -55.00 -60.95 -66.60 -55.46 . . 0 "[ . 1 . 2]"
10 PSI 1 23 THR N 1 23 THR CA 1 23 THR C 1 24 LEU N -52.00 -32.00 -52.78 -53.03 -53.29 2.64 9 0 "[ . 1 . 2]"
11 PHI 1 23 THR C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -73.00 -53.00 -66.72 -63.76 -64.99 . . 0 "[ . 1 . 2]"
12 PSI 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 GLU N -50.00 -30.00 -32.76 -45.49 -28.82 1.18 3 0 "[ . 1 . 2]"
13 PHI 1 24 LEU C 1 25 GLU N 1 25 GLU CA 1 25 GLU C -74.00 -54.00 -61.48 -69.52 -55.54 . . 0 "[ . 1 . 2]"
14 PSI 1 25 GLU N 1 25 GLU CA 1 25 GLU C 1 26 THR N -48.00 -28.00 -43.40 -40.90 -42.84 1.40 17 0 "[ . 1 . 2]"
15 PHI 1 25 GLU C 1 26 THR N 1 26 THR CA 1 26 THR C -73.00 -53.00 -66.98 -66.39 -66.72 0.31 10 0 "[ . 1 . 2]"
16 PSI 1 26 THR N 1 26 THR CA 1 26 THR C 1 27 VAL N -56.00 -36.00 -43.63 -45.76 -47.58 . . 0 "[ . 1 . 2]"
17 PHI 1 26 THR C 1 27 VAL N 1 27 VAL CA 1 27 VAL C -74.00 -54.00 -60.28 -64.08 -57.33 . . 0 "[ . 1 . 2]"
18 PSI 1 27 VAL N 1 27 VAL CA 1 27 VAL C 1 28 TYR N -53.00 -33.00 -39.72 -38.69 -39.79 . . 0 "[ . 1 . 2]"
19 PHI 1 27 VAL C 1 28 TYR N 1 28 TYR CA 1 28 TYR C -69.00 -49.00 -59.75 -63.22 -54.36 . . 0 "[ . 1 . 2]"
20 PSI 1 28 TYR N 1 28 TYR CA 1 28 TYR C 1 29 ARG N -55.00 -35.00 -48.60 -55.08 -39.80 0.08 6 0 "[ . 1 . 2]"
21 PHI 1 28 TYR C 1 29 ARG N 1 29 ARG CA 1 29 ARG C -70.00 -50.00 -63.55 -61.03 -62.85 0.27 9 0 "[ . 1 . 2]"
22 PSI 1 29 ARG N 1 29 ARG CA 1 29 ARG C 1 30 ALA N -51.00 -31.00 -35.55 -48.46 -28.84 2.16 6 0 "[ . 1 . 2]"
23 PHI 1 29 ARG C 1 30 ALA N 1 30 ALA CA 1 30 ALA C -71.00 -51.00 -61.91 -71.68 -54.12 0.68 12 0 "[ . 1 . 2]"
24 PSI 1 30 ALA N 1 30 ALA CA 1 30 ALA C 1 31 LEU N -56.00 -36.00 -44.90 -44.00 -45.39 0.29 6 0 "[ . 1 . 2]"
25 PHI 1 30 ALA C 1 31 LEU N 1 31 LEU CA 1 31 LEU C -73.00 -53.00 -73.02 -71.44 -72.58 2.03 6 0 "[ . 1 . 2]"
26 PSI 1 31 LEU N 1 31 LEU CA 1 31 LEU C 1 32 GLU N -50.00 -30.00 -33.72 -51.03 -28.99 1.03 16 0 "[ . 1 . 2]"
27 PHI 1 31 LEU C 1 32 GLU N 1 32 GLU CA 1 32 GLU C -76.00 -56.00 -67.12 -75.36 -59.50 . . 0 "[ . 1 . 2]"
28 PSI 1 32 GLU N 1 32 GLU CA 1 32 GLU C 1 33 GLU N -49.00 -29.00 -37.92 -36.08 -37.47 0.84 9 0 "[ . 1 . 2]"
29 PHI 1 32 GLU C 1 33 GLU N 1 33 GLU CA 1 33 GLU C -75.00 -55.00 -67.81 -69.61 -70.87 0.33 18 0 "[ . 1 . 2]"
30 PSI 1 33 GLU N 1 33 GLU CA 1 33 GLU C 1 34 LYS N -45.00 -25.00 -30.36 -30.51 -34.02 1.22 5 0 "[ . 1 . 2]"
31 PHI 1 33 GLU C 1 34 LYS N 1 34 LYS CA 1 34 LYS C -96.00 -76.00 -87.14 -96.40 -76.86 0.40 19 0 "[ . 1 . 2]"
32 PSI 1 34 LYS N 1 34 LYS CA 1 34 LYS C 1 35 GLY N -9.00 13.00 -8.31 -11.10 0.75 2.10 20 0 "[ . 1 . 2]"
33 PHI 1 34 LYS C 1 35 GLY N 1 35 GLY CA 1 35 GLY C 63.00 99.00 77.43 81.95 80.59 1.00 20 0 "[ . 1 . 2]"
34 PSI 1 35 GLY N 1 35 GLY CA 1 35 GLY C 1 36 TYR N -2.00 38.00 29.14 14.02 39.72 1.72 4 0 "[ . 1 . 2]"
35 PSI 1 38 PRO N 1 38 PRO CA 1 38 PRO C 1 39 ILE N -40.00 -32.00 -40.61 -41.13 -41.32 2.15 5 0 "[ . 1 . 2]"
36 PHI 1 38 PRO C 1 39 ILE N 1 39 ILE CA 1 39 ILE C -78.00 -56.00 -67.21 -78.06 -56.03 0.06 16 0 "[ . 1 . 2]"
37 PSI 1 39 ILE N 1 39 ILE CA 1 39 ILE C 1 40 ASN N -47.00 -25.00 -45.39 -48.53 -39.40 1.53 9 0 "[ . 1 . 2]"
38 PHI 1 39 ILE C 1 40 ASN N 1 40 ASN CA 1 40 ASN C -70.00 -50.00 -61.44 -71.76 -50.02 1.76 9 0 "[ . 1 . 2]"
39 PSI 1 40 ASN N 1 40 ASN CA 1 40 ASN C 1 41 GLN N -52.00 -32.00 -40.26 -38.93 -40.54 0.90 9 0 "[ . 1 . 2]"
40 PHI 1 40 ASN C 1 41 GLN N 1 41 GLN CA 1 41 GLN C -73.00 -53.00 -72.90 -71.81 -73.08 2.26 6 0 "[ . 1 . 2]"
41 PSI 1 41 GLN N 1 41 GLN CA 1 41 GLN C 1 42 ILE N -54.00 -34.00 -37.10 -36.52 -37.30 1.36 13 0 "[ . 1 . 2]"
42 PHI 1 41 GLN C 1 42 ILE N 1 42 ILE CA 1 42 ILE C -73.00 -53.00 -67.13 -71.83 -63.92 . . 0 "[ . 1 . 2]"
43 PSI 1 42 ILE N 1 42 ILE CA 1 42 ILE C 1 43 VAL N -56.00 -36.00 -50.23 -48.30 -49.20 . . 0 "[ . 1 . 2]"
44 PHI 1 42 ILE C 1 43 VAL N 1 43 VAL CA 1 43 VAL C -71.00 -51.00 -59.38 -65.44 -57.11 . . 0 "[ . 1 . 2]"
45 PSI 1 43 VAL N 1 43 VAL CA 1 43 VAL C 1 44 GLY N -56.00 -36.00 -38.28 -41.29 -41.91 0.49 9 0 "[ . 1 . 2]"
46 PHI 1 43 VAL C 1 44 GLY N 1 44 GLY CA 1 44 GLY C -74.00 -54.00 -63.16 -67.10 -59.59 . . 0 "[ . 1 . 2]"
47 PSI 1 44 GLY N 1 44 GLY CA 1 44 GLY C 1 45 TYR N -52.00 -32.00 -42.19 -37.59 -38.76 . . 0 "[ . 1 . 2]"
48 PHI 1 44 GLY C 1 45 TYR N 1 45 TYR CA 1 45 TYR C -73.00 -53.00 -62.33 -67.35 -58.28 . . 0 "[ . 1 . 2]"
49 PSI 1 45 TYR N 1 45 TYR CA 1 45 TYR C 1 46 LEU N -55.00 -35.00 -51.53 -56.06 -42.75 1.06 4 0 "[ . 1 . 2]"
50 PHI 1 45 TYR C 1 46 LEU N 1 46 LEU CA 1 46 LEU C -68.00 -48.00 -65.40 -66.68 -67.68 0.51 20 0 "[ . 1 . 2]"
51 PSI 1 46 LEU N 1 46 LEU CA 1 46 LEU C 1 47 LEU N -56.00 -36.00 -37.34 -35.78 -35.85 1.92 5 0 "[ . 1 . 2]"
52 PHI 1 47 LEU C 1 48 SER N 1 48 SER CA 1 48 SER C -128.00 -92.00 -106.80 -114.30 -127.36 1.48 7 0 "[ . 1 . 2]"
53 PSI 1 48 SER N 1 48 SER CA 1 48 SER C 1 49 GLY N -24.00 -4.00 -24.28 -24.57 -24.62 2.20 6 0 "[ . 1 . 2]"
54 PSI 1 51 PRO N 1 51 PRO CA 1 51 PRO C 1 52 ALA N -42.00 -26.00 -24.16 -25.16 -25.82 2.84 11 0 "[ . 1 . 2]"
55 PHI 1 51 PRO C 1 52 ALA N 1 52 ALA CA 1 52 ALA C -77.00 -57.00 -62.10 -65.56 -66.46 0.71 7 0 "[ . 1 . 2]"
56 PSI 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 TYR N -43.00 -13.00 -13.55 -19.83 -10.35 2.65 1 0 "[ . 1 . 2]"
57 PHI 1 52 ALA C 1 53 TYR N 1 53 TYR CA 1 53 TYR C -89.00 -67.00 -67.81 -72.47 -65.60 1.40 19 0 "[ . 1 . 2]"
58 PSI 1 53 TYR N 1 53 TYR CA 1 53 TYR C 1 54 ILE N -31.00 -7.00 -25.07 -20.43 -23.48 1.81 18 0 "[ . 1 . 2]"
59 PSI 1 55 PRO N 1 55 PRO CA 1 55 PRO C 1 56 ARG N 139.00 163.00 147.66 149.49 147.58 0.97 19 0 "[ . 1 . 2]"
60 PHI 1 58 GLN C 1 59 ASP N 1 59 ASP CA 1 59 ASP C -86.00 -56.00 -63.99 -58.42 -58.88 0.15 20 0 "[ . 1 . 2]"
61 PSI 1 59 ASP N 1 59 ASP CA 1 59 ASP C 1 60 ALA N -46.00 -14.00 -11.67 -13.60 -9.56 4.44 17 0 "[ . 1 . 2]"
62 PHI 1 59 ASP C 1 60 ALA N 1 60 ALA CA 1 60 ALA C -70.00 -50.00 -50.14 -56.76 -47.81 2.19 19 0 "[ . 1 . 2]"
63 PSI 1 60 ALA N 1 60 ALA CA 1 60 ALA C 1 61 ARG N -53.00 -31.00 -37.14 -35.35 -36.41 0.17 10 0 "[ . 1 . 2]"
64 PHI 1 60 ALA C 1 61 ARG N 1 61 ARG CA 1 61 ARG C -73.00 -53.00 -61.48 -65.44 -53.21 . . 0 "[ . 1 . 2]"
65 PSI 1 61 ARG N 1 61 ARG CA 1 61 ARG C 1 62 ASN N -55.00 -35.00 -36.88 -48.68 -33.58 1.42 17 0 "[ . 1 . 2]"
66 PHI 1 61 ARG C 1 62 ASN N 1 62 ASN CA 1 62 ASN C -75.00 -55.00 -75.09 -73.07 -75.31 3.07 18 0 "[ . 1 . 2]"
67 PSI 1 62 ASN N 1 62 ASN CA 1 62 ASN C 1 63 LEU N -51.00 -31.00 -41.48 -42.94 -43.33 . . 0 "[ . 1 . 2]"
68 PHI 1 62 ASN C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -75.00 -55.00 -59.87 -72.14 -54.41 0.59 9 0 "[ . 1 . 2]"
69 PSI 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 ILE N -49.00 -29.00 -44.58 -49.35 -36.46 0.35 12 0 "[ . 1 . 2]"
70 PHI 1 63 LEU C 1 64 ILE N 1 64 ILE CA 1 64 ILE C -79.00 -59.00 -71.44 -79.10 -65.97 0.10 15 0 "[ . 1 . 2]"
71 PSI 1 64 ILE N 1 64 ILE CA 1 64 ILE C 1 65 ARG N -34.00 -12.00 -25.22 -17.56 -21.74 0.32 14 0 "[ . 1 . 2]"
72 PHI 1 65 ARG C 1 66 ARG N 1 66 ARG CA 1 66 ARG C -108.00 -78.00 -83.23 -94.71 -76.44 1.56 6 0 "[ . 1 . 2]"
73 PSI 1 66 ARG N 1 66 ARG CA 1 66 ARG C 1 67 HIS N -39.00 9.00 -6.25 -36.05 9.78 0.78 15 0 "[ . 1 . 2]"
74 PHI 1 70 ASP C 1 71 GLU N 1 71 GLU CA 1 71 GLU C -74.00 -54.00 -58.67 -72.13 -52.92 1.08 5 0 "[ . 1 . 2]"
75 PSI 1 71 GLU N 1 71 GLU CA 1 71 GLU C 1 72 ILE N -55.00 -35.00 -46.73 -42.98 -45.26 1.22 4 0 "[ . 1 . 2]"
76 PHI 1 71 GLU C 1 72 ILE N 1 72 ILE CA 1 72 ILE C -74.00 -54.00 -63.70 -74.54 -57.57 0.54 7 0 "[ . 1 . 2]"
77 PSI 1 72 ILE N 1 72 ILE CA 1 72 ILE C 1 73 MET N -54.00 -34.00 -44.27 -49.78 -37.06 . . 0 "[ . 1 . 2]"
78 PHI 1 72 ILE C 1 73 MET N 1 73 MET CA 1 73 MET C -73.00 -53.00 -63.85 -63.68 -64.33 . . 0 "[ . 1 . 2]"
79 PSI 1 73 MET N 1 73 MET CA 1 73 MET C 1 74 GLU N -51.00 -29.00 -40.04 -33.22 -36.80 . . 0 "[ . 1 . 2]"
80 PHI 1 73 MET C 1 74 GLU N 1 74 GLU CA 1 74 GLU C -78.00 -58.00 -61.48 -70.51 -57.40 0.60 19 0 "[ . 1 . 2]"
81 PSI 1 74 GLU N 1 74 GLU CA 1 74 GLU C 1 75 GLU N -51.00 -31.00 -40.35 -51.91 -29.43 1.57 11 0 "[ . 1 . 2]"
82 PHI 1 74 GLU C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -71.00 -51.00 -66.49 -73.03 -54.33 2.03 16 0 "[ . 1 . 2]"
83 PSI 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 LEU N -54.00 -34.00 -40.62 -51.51 -33.92 0.08 8 0 "[ . 1 . 2]"
84 PHI 1 75 GLU C 1 76 LEU N 1 76 LEU CA 1 76 LEU C -72.00 -52.00 -58.28 -58.57 -59.38 . . 0 "[ . 1 . 2]"
85 PSI 1 76 LEU N 1 76 LEU CA 1 76 LEU C 1 77 THR N -49.00 -29.00 -48.46 -49.36 -49.49 0.93 20 0 "[ . 1 . 2]"
86 PHI 1 76 LEU C 1 77 THR N 1 77 THR CA 1 77 THR C -78.00 -58.00 -63.61 -63.67 -63.70 0.62 3 0 "[ . 1 . 2]"
87 PSI 1 77 THR N 1 77 THR CA 1 77 THR C 1 78 LYS N -51.00 -31.00 -44.50 -52.17 -37.59 1.17 7 0 "[ . 1 . 2]"
88 PHI 1 77 THR C 1 78 LYS N 1 78 LYS CA 1 78 LYS C -71.00 -51.00 -65.64 -72.85 -59.45 1.85 7 0 "[ . 1 . 2]"
89 PSI 1 78 LYS N 1 78 LYS CA 1 78 LYS C 1 79 TYR N -54.00 -34.00 -48.11 -54.48 -33.69 0.48 9 0 "[ . 1 . 2]"
90 PHI 1 78 LYS C 1 79 TYR N 1 79 TYR CA 1 79 TYR C -73.00 -53.00 -65.08 -63.00 -63.50 1.05 19 0 "[ . 1 . 2]"
91 PSI 1 79 TYR N 1 79 TYR CA 1 79 TYR C 1 80 TYR N -53.00 -33.00 -36.54 -41.55 -31.84 1.16 17 0 "[ . 1 . 2]"
92 PHI 1 79 TYR C 1 80 TYR N 1 80 TYR CA 1 80 TYR C -72.00 -52.00 -60.15 -69.62 -56.76 . . 0 "[ . 1 . 2]"
93 PSI 1 80 TYR N 1 80 TYR CA 1 80 TYR C 1 81 LEU N -54.00 -34.00 -48.05 -48.61 -49.23 0.44 17 0 "[ . 1 . 2]"
94 PHI 1 80 TYR C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -72.00 -52.00 -72.42 -73.42 -73.78 3.52 3 0 "[ . 1 . 2]"
95 PSI 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 ALA N -47.00 -25.00 -32.10 -41.27 -24.80 0.20 17 0 "[ . 1 . 2]"
96 PHI 1 81 LEU C 1 82 ALA N 1 82 ALA CA 1 82 ALA C -72.00 -52.00 -61.96 -62.65 -63.73 0.01 3 0 "[ . 1 . 2]"
97 PSI 1 82 ALA N 1 82 ALA CA 1 82 ALA C 1 83 ASN N -47.00 -25.00 -35.21 -34.17 -36.21 0.96 1 0 "[ . 1 . 2]"
98 PHI 1 82 ALA C 1 83 ASN N 1 83 ASN CA 1 83 ASN C -87.00 -61.00 -72.80 -67.72 -69.59 0.15 12 0 "[ . 1 . 2]"
99 PSI 1 83 ASN N 1 83 ASN CA 1 83 ASN C 1 84 HIS N -30.00 4.00 -5.29 -26.00 4.66 0.66 6 0 "[ . 1 . 2]"
100 PHI 1 84 HIS C 1 85 GLY N 1 85 GLY CA 1 85 GLY C 69.00 103.00 87.71 77.04 103.87 0.87 8 0 "[ . 1 . 2]"
101 PSI 1 85 GLY N 1 85 GLY CA 1 85 GLY C 1 86 ILE N -4.00 22.00 16.27 7.58 1.86 1.08 11 0 "[ . 1 . 2]"
102 PHI 1 85 GLY C 1 86 ILE N 1 86 ILE CA 1 86 ILE C -100.00 -72.00 -97.53 -96.21 -98.30 0.89 12 0 "[ . 1 . 2]"
103 PSI 1 86 ILE N 1 86 ILE CA 1 86 ILE C 1 87 ASP N 118.00 146.00 130.76 131.67 130.55 0.99 8 0 "[ . 1 . 2]"
104 PHI 1 86 ILE C 1 87 ASP N 1 87 ASP CA 1 87 ASP C -102.00 -68.00 -95.90 -102.89 -85.73 0.89 4 0 "[ . 1 . 2]"
105 PSI 1 87 ASP N 1 87 ASP CA 1 87 ASP C 1 88 ILE N 120.00 150.00 121.22 121.71 120.70 2.12 13 0 "[ . 1 . 2]"
106 PHI 1 87 ASP C 1 88 ILE N 1 88 ILE CA 1 88 ILE C -124.00 -90.00 -101.47 -117.10 -89.42 0.58 16 0 "[ . 1 . 2]"
107 PSI 1 88 ILE N 1 88 ILE CA 1 88 ILE C 1 89 LYS N 111.00 149.00 136.26 120.74 147.13 . . 0 "[ . 1 . 2]"
108 PHI 2 18 LYS C 2 19 ALA N 2 19 ALA CA 2 19 ALA C -73.00 -53.00 -63.97 -61.80 -64.47 0.98 14 0 "[ . 1 . 2]"
109 PSI 2 19 ALA N 2 19 ALA CA 2 19 ALA C 2 20 ILE N -48.00 -28.00 -37.29 -48.33 -26.80 1.20 14 0 "[ . 1 . 2]"
110 PHI 2 19 ALA C 2 20 ILE N 2 20 ILE CA 2 20 ILE C -73.00 -53.00 -62.05 -67.61 -52.80 0.20 14 0 "[ . 1 . 2]"
111 PSI 2 20 ILE N 2 20 ILE CA 2 20 ILE C 2 21 SER N -53.00 -33.00 -34.70 -38.30 -31.84 1.16 4 0 "[ . 1 . 2]"
112 PHI 2 20 ILE C 2 21 SER N 2 21 SER CA 2 21 SER C -75.00 -55.00 -69.04 -75.60 -60.04 0.60 8 0 "[ . 1 . 2]"
113 PSI 2 21 SER N 2 21 SER CA 2 21 SER C 2 22 GLU N -51.00 -31.00 -41.60 -48.79 -33.90 . . 0 "[ . 1 . 2]"
114 PHI 2 21 SER C 2 22 GLU N 2 22 GLU CA 2 22 GLU C -75.00 -55.00 -66.53 -64.58 -67.25 1.40 18 0 "[ . 1 . 2]"
115 PSI 2 22 GLU N 2 22 GLU CA 2 22 GLU C 2 23 THR N -48.00 -28.00 -39.23 -33.84 -36.26 0.12 10 0 "[ . 1 . 2]"
116 PHI 2 22 GLU C 2 23 THR N 2 23 THR CA 2 23 THR C -75.00 -55.00 -61.82 -67.44 -56.08 . . 0 "[ . 1 . 2]"
117 PSI 2 23 THR N 2 23 THR CA 2 23 THR C 2 24 LEU N -52.00 -32.00 -52.98 -54.84 -49.38 2.84 13 0 "[ . 1 . 2]"
118 PHI 2 23 THR C 2 24 LEU N 2 24 LEU CA 2 24 LEU C -73.00 -53.00 -67.37 -73.41 -59.43 0.41 18 0 "[ . 1 . 2]"
119 PSI 2 24 LEU N 2 24 LEU CA 2 24 LEU C 2 25 GLU N -50.00 -30.00 -32.43 -46.61 -29.12 0.88 14 0 "[ . 1 . 2]"
120 PHI 2 24 LEU C 2 25 GLU N 2 25 GLU CA 2 25 GLU C -74.00 -54.00 -60.27 -59.26 -60.43 . . 0 "[ . 1 . 2]"
121 PSI 2 25 GLU N 2 25 GLU CA 2 25 GLU C 2 26 THR N -48.00 -28.00 -44.25 -49.13 -37.66 1.13 12 0 "[ . 1 . 2]"
122 PHI 2 25 GLU C 2 26 THR N 2 26 THR CA 2 26 THR C -73.00 -53.00 -67.91 -75.50 -56.44 2.50 18 0 "[ . 1 . 2]"
123 PSI 2 26 THR N 2 26 THR CA 2 26 THR C 2 27 VAL N -56.00 -36.00 -43.47 -46.02 -48.46 0.26 13 0 "[ . 1 . 2]"
124 PHI 2 26 THR C 2 27 VAL N 2 27 VAL CA 2 27 VAL C -74.00 -54.00 -59.74 -66.39 -53.63 0.37 19 0 "[ . 1 . 2]"
125 PSI 2 27 VAL N 2 27 VAL CA 2 27 VAL C 2 28 TYR N -53.00 -33.00 -40.28 -39.60 -39.85 . . 0 "[ . 1 . 2]"
126 PHI 2 27 VAL C 2 28 TYR N 2 28 TYR CA 2 28 TYR C -69.00 -49.00 -60.38 -61.10 -61.62 . . 0 "[ . 1 . 2]"
127 PSI 2 28 TYR N 2 28 TYR CA 2 28 TYR C 2 29 ARG N -55.00 -35.00 -48.22 -55.56 -42.15 0.56 7 0 "[ . 1 . 2]"
128 PHI 2 28 TYR C 2 29 ARG N 2 29 ARG CA 2 29 ARG C -70.00 -50.00 -62.42 -57.78 -58.50 . . 0 "[ . 1 . 2]"
129 PSI 2 29 ARG N 2 29 ARG CA 2 29 ARG C 2 30 ALA N -51.00 -31.00 -36.22 -45.25 -29.87 1.13 19 0 "[ . 1 . 2]"
130 PHI 2 29 ARG C 2 30 ALA N 2 30 ALA CA 2 30 ALA C -71.00 -51.00 -61.95 -57.52 -58.38 0.35 15 0 "[ . 1 . 2]"
131 PSI 2 30 ALA N 2 30 ALA CA 2 30 ALA C 2 31 LEU N -56.00 -36.00 -45.53 -55.02 -36.13 . . 0 "[ . 1 . 2]"
132 PHI 2 30 ALA C 2 31 LEU N 2 31 LEU CA 2 31 LEU C -73.00 -53.00 -73.23 -72.30 -72.92 1.72 13 0 "[ . 1 . 2]"
133 PSI 2 31 LEU N 2 31 LEU CA 2 31 LEU C 2 32 GLU N -50.00 -30.00 -32.85 -49.31 -28.34 1.66 14 0 "[ . 1 . 2]"
134 PHI 2 31 LEU C 2 32 GLU N 2 32 GLU CA 2 32 GLU C -76.00 -56.00 -66.76 -74.75 -56.11 . . 0 "[ . 1 . 2]"
135 PSI 2 32 GLU N 2 32 GLU CA 2 32 GLU C 2 33 GLU N -49.00 -29.00 -38.33 -37.36 -38.75 0.25 19 0 "[ . 1 . 2]"
136 PHI 2 32 GLU C 2 33 GLU N 2 33 GLU CA 2 33 GLU C -75.00 -55.00 -67.42 -74.98 -61.46 . . 0 "[ . 1 . 2]"
137 PSI 2 33 GLU N 2 33 GLU CA 2 33 GLU C 2 34 LYS N -45.00 -25.00 -29.53 -37.59 -23.61 1.39 3 0 "[ . 1 . 2]"
138 PHI 2 33 GLU C 2 34 LYS N 2 34 LYS CA 2 34 LYS C -96.00 -76.00 -88.57 -82.22 -86.18 0.27 9 0 "[ . 1 . 2]"
139 PSI 2 34 LYS N 2 34 LYS CA 2 34 LYS C 2 35 GLY N -9.00 13.00 -6.63 -10.14 2.77 1.14 15 0 "[ . 1 . 2]"
140 PHI 2 34 LYS C 2 35 GLY N 2 35 GLY CA 2 35 GLY C 63.00 99.00 75.47 75.33 72.65 0.24 4 0 "[ . 1 . 2]"
141 PSI 2 35 GLY N 2 35 GLY CA 2 35 GLY C 2 36 TYR N -2.00 38.00 28.83 10.91 39.37 1.37 16 0 "[ . 1 . 2]"
142 PSI 2 38 PRO N 2 38 PRO CA 2 38 PRO C 2 39 ILE N -40.00 -32.00 -40.88 -41.38 -41.47 2.54 15 0 "[ . 1 . 2]"
143 PHI 2 38 PRO C 2 39 ILE N 2 39 ILE CA 2 39 ILE C -78.00 -56.00 -66.77 -80.11 -54.49 2.11 6 0 "[ . 1 . 2]"
144 PSI 2 39 ILE N 2 39 ILE CA 2 39 ILE C 2 40 ASN N -47.00 -25.00 -44.97 -47.45 -37.92 0.45 6 0 "[ . 1 . 2]"
145 PHI 2 39 ILE C 2 40 ASN N 2 40 ASN CA 2 40 ASN C -70.00 -50.00 -61.36 -68.65 -55.23 . . 0 "[ . 1 . 2]"
146 PSI 2 40 ASN N 2 40 ASN CA 2 40 ASN C 2 41 GLN N -52.00 -32.00 -39.53 -41.99 -44.80 . . 0 "[ . 1 . 2]"
147 PHI 2 40 ASN C 2 41 GLN N 2 41 GLN CA 2 41 GLN C -73.00 -53.00 -73.30 -75.16 -75.60 2.80 15 0 "[ . 1 . 2]"
148 PSI 2 41 GLN N 2 41 GLN CA 2 41 GLN C 2 42 ILE N -54.00 -34.00 -36.49 -35.18 -36.12 0.45 2 0 "[ . 1 . 2]"
149 PHI 2 41 GLN C 2 42 ILE N 2 42 ILE CA 2 42 ILE C -73.00 -53.00 -67.63 -73.33 -60.66 0.33 12 0 "[ . 1 . 2]"
150 PSI 2 42 ILE N 2 42 ILE CA 2 42 ILE C 2 43 VAL N -56.00 -36.00 -50.09 -55.85 -43.68 . . 0 "[ . 1 . 2]"
151 PHI 2 42 ILE C 2 43 VAL N 2 43 VAL CA 2 43 VAL C -71.00 -51.00 -59.14 -63.16 -54.68 . . 0 "[ . 1 . 2]"
152 PSI 2 43 VAL N 2 43 VAL CA 2 43 VAL C 2 44 GLY N -56.00 -36.00 -39.66 -39.86 -40.85 0.57 3 0 "[ . 1 . 2]"
153 PHI 2 43 VAL C 2 44 GLY N 2 44 GLY CA 2 44 GLY C -74.00 -54.00 -63.73 -69.03 -59.90 . . 0 "[ . 1 . 2]"
154 PSI 2 44 GLY N 2 44 GLY CA 2 44 GLY C 2 45 TYR N -52.00 -32.00 -41.29 -50.59 -34.06 . . 0 "[ . 1 . 2]"
155 PHI 2 44 GLY C 2 45 TYR N 2 45 TYR CA 2 45 TYR C -73.00 -53.00 -60.59 -66.82 -56.69 . . 0 "[ . 1 . 2]"
156 PSI 2 45 TYR N 2 45 TYR CA 2 45 TYR C 2 46 LEU N -55.00 -35.00 -52.44 -57.34 -46.97 2.34 12 0 "[ . 1 . 2]"
157 PHI 2 45 TYR C 2 46 LEU N 2 46 LEU CA 2 46 LEU C -68.00 -48.00 -65.32 -67.02 -68.10 0.73 18 0 "[ . 1 . 2]"
158 PSI 2 46 LEU N 2 46 LEU CA 2 46 LEU C 2 47 LEU N -56.00 -36.00 -37.39 -37.78 -39.42 1.79 11 0 "[ . 1 . 2]"
159 PHI 2 47 LEU C 2 48 SER N 2 48 SER CA 2 48 SER C -128.00 -92.00 -104.32 -101.05 -106.91 0.83 7 0 "[ . 1 . 2]"
160 PSI 2 48 SER N 2 48 SER CA 2 48 SER C 2 49 GLY N -24.00 -4.00 -21.42 -24.26 -24.33 1.93 3 0 "[ . 1 . 2]"
161 PSI 2 51 PRO N 2 51 PRO CA 2 51 PRO C 2 52 ALA N -42.00 -26.00 -24.09 -24.44 -24.57 3.54 6 0 "[ . 1 . 2]"
162 PHI 2 51 PRO C 2 52 ALA N 2 52 ALA CA 2 52 ALA C -77.00 -57.00 -64.15 -62.63 -63.31 1.40 17 0 "[ . 1 . 2]"
163 PSI 2 52 ALA N 2 52 ALA CA 2 52 ALA C 2 53 TYR N -43.00 -13.00 -13.08 -12.25 -12.33 1.69 6 0 "[ . 1 . 2]"
164 PHI 2 52 ALA C 2 53 TYR N 2 53 TYR CA 2 53 TYR C -89.00 -67.00 -67.57 -74.92 -64.32 2.68 9 0 "[ . 1 . 2]"
165 PSI 2 53 TYR N 2 53 TYR CA 2 53 TYR C 2 54 ILE N -31.00 -7.00 -24.37 -31.95 -14.33 0.95 13 0 "[ . 1 . 2]"
166 PSI 2 55 PRO N 2 55 PRO CA 2 55 PRO C 2 56 ARG N 139.00 163.00 148.61 137.89 164.25 1.25 20 0 "[ . 1 . 2]"
167 PHI 2 58 GLN C 2 59 ASP N 2 59 ASP CA 2 59 ASP C -86.00 -56.00 -60.86 -70.93 -55.91 0.09 5 0 "[ . 1 . 2]"
168 PSI 2 59 ASP N 2 59 ASP CA 2 59 ASP C 2 60 ALA N -46.00 -14.00 -12.17 -14.08 -10.33 3.67 20 0 "[ . 1 . 2]"
169 PHI 2 59 ASP C 2 60 ALA N 2 60 ALA CA 2 60 ALA C -70.00 -50.00 -50.06 -54.96 -47.80 2.20 19 0 "[ . 1 . 2]"
170 PSI 2 60 ALA N 2 60 ALA CA 2 60 ALA C 2 61 ARG N -53.00 -31.00 -38.92 -51.20 -31.55 . . 0 "[ . 1 . 2]"
171 PHI 2 60 ALA C 2 61 ARG N 2 61 ARG CA 2 61 ARG C -73.00 -53.00 -62.12 -59.55 -60.52 0.01 7 0 "[ . 1 . 2]"
172 PSI 2 61 ARG N 2 61 ARG CA 2 61 ARG C 2 62 ASN N -55.00 -35.00 -37.44 -50.10 -32.84 2.16 11 0 "[ . 1 . 2]"
173 PHI 2 61 ARG C 2 62 ASN N 2 62 ASN CA 2 62 ASN C -75.00 -55.00 -74.13 -75.47 -76.03 3.25 3 0 "[ . 1 . 2]"
174 PSI 2 62 ASN N 2 62 ASN CA 2 62 ASN C 2 63 LEU N -51.00 -31.00 -42.44 -30.77 -37.62 0.23 2 0 "[ . 1 . 2]"
175 PHI 2 62 ASN C 2 63 LEU N 2 63 LEU CA 2 63 LEU C -75.00 -55.00 -58.91 -65.10 -54.83 0.17 11 0 "[ . 1 . 2]"
176 PSI 2 63 LEU N 2 63 LEU CA 2 63 LEU C 2 64 ILE N -49.00 -29.00 -44.67 -44.52 -45.84 0.99 1 0 "[ . 1 . 2]"
177 PHI 2 63 LEU C 2 64 ILE N 2 64 ILE CA 2 64 ILE C -79.00 -59.00 -69.52 -59.06 -64.04 . . 0 "[ . 1 . 2]"
178 PSI 2 64 ILE N 2 64 ILE CA 2 64 ILE C 2 65 ARG N -34.00 -12.00 -23.60 -34.28 -11.62 0.38 6 0 "[ . 1 . 2]"
179 PHI 2 65 ARG C 2 66 ARG N 2 66 ARG CA 2 66 ARG C -108.00 -78.00 -86.32 -109.31 -77.07 1.31 2 0 "[ . 1 . 2]"
180 PSI 2 66 ARG N 2 66 ARG CA 2 66 ARG C 2 67 HIS N -39.00 9.00 -3.46 -0.52 -6.50 0.88 15 0 "[ . 1 . 2]"
181 PHI 2 70 ASP C 2 71 GLU N 2 71 GLU CA 2 71 GLU C -74.00 -54.00 -59.00 -73.62 -52.55 1.45 5 0 "[ . 1 . 2]"
182 PSI 2 71 GLU N 2 71 GLU CA 2 71 GLU C 2 72 ILE N -55.00 -35.00 -46.49 -55.35 -34.21 0.79 12 0 "[ . 1 . 2]"
183 PHI 2 71 GLU C 2 72 ILE N 2 72 ILE CA 2 72 ILE C -74.00 -54.00 -65.15 -65.87 -67.01 . . 0 "[ . 1 . 2]"
184 PSI 2 72 ILE N 2 72 ILE CA 2 72 ILE C 2 73 MET N -54.00 -34.00 -44.24 -42.79 -43.07 . . 0 "[ . 1 . 2]"
185 PHI 2 72 ILE C 2 73 MET N 2 73 MET CA 2 73 MET C -73.00 -53.00 -64.09 -69.19 -57.80 . . 0 "[ . 1 . 2]"
186 PSI 2 73 MET N 2 73 MET CA 2 73 MET C 2 74 GLU N -51.00 -29.00 -40.21 -38.80 -40.18 . . 0 "[ . 1 . 2]"
187 PHI 2 73 MET C 2 74 GLU N 2 74 GLU CA 2 74 GLU C -78.00 -58.00 -60.91 -61.10 -62.45 1.11 8 0 "[ . 1 . 2]"
188 PSI 2 74 GLU N 2 74 GLU CA 2 74 GLU C 2 75 GLU N -51.00 -31.00 -41.70 -51.97 -30.44 0.97 12 0 "[ . 1 . 2]"
189 PHI 2 74 GLU C 2 75 GLU N 2 75 GLU CA 2 75 GLU C -71.00 -51.00 -64.82 -59.79 -61.95 0.48 18 0 "[ . 1 . 2]"
190 PSI 2 75 GLU N 2 75 GLU CA 2 75 GLU C 2 76 LEU N -54.00 -34.00 -42.02 -48.00 -33.84 0.16 9 0 "[ . 1 . 2]"
191 PHI 2 75 GLU C 2 76 LEU N 2 76 LEU CA 2 76 LEU C -72.00 -52.00 -58.19 -59.62 -60.45 . . 0 "[ . 1 . 2]"
192 PSI 2 76 LEU N 2 76 LEU CA 2 76 LEU C 2 77 THR N -49.00 -29.00 -49.30 -50.47 -46.43 1.47 15 0 "[ . 1 . 2]"
193 PHI 2 76 LEU C 2 77 THR N 2 77 THR CA 2 77 THR C -78.00 -58.00 -62.87 -72.68 -57.64 0.36 11 0 "[ . 1 . 2]"
194 PSI 2 77 THR N 2 77 THR CA 2 77 THR C 2 78 LYS N -51.00 -31.00 -44.24 -45.30 -46.01 0.32 9 0 "[ . 1 . 2]"
195 PHI 2 77 THR C 2 78 LYS N 2 78 LYS CA 2 78 LYS C -71.00 -51.00 -66.42 -72.31 -58.93 1.31 7 0 "[ . 1 . 2]"
196 PSI 2 78 LYS N 2 78 LYS CA 2 78 LYS C 2 79 TYR N -54.00 -34.00 -47.45 -54.29 -35.39 0.29 9 0 "[ . 1 . 2]"
197 PHI 2 78 LYS C 2 79 TYR N 2 79 TYR CA 2 79 TYR C -73.00 -53.00 -65.56 -73.35 -62.04 0.35 19 0 "[ . 1 . 2]"
198 PSI 2 79 TYR N 2 79 TYR CA 2 79 TYR C 2 80 TYR N -53.00 -33.00 -36.25 -33.25 -34.01 1.23 3 0 "[ . 1 . 2]"
199 PHI 2 79 TYR C 2 80 TYR N 2 80 TYR CA 2 80 TYR C -72.00 -52.00 -60.19 -66.73 -56.19 . . 0 "[ . 1 . 2]"
200 PSI 2 80 TYR N 2 80 TYR CA 2 80 TYR C 2 81 LEU N -54.00 -34.00 -49.26 -54.37 -37.38 0.37 15 0 "[ . 1 . 2]"
201 PHI 2 80 TYR C 2 81 LEU N 2 81 LEU CA 2 81 LEU C -72.00 -52.00 -72.41 -73.65 -73.97 2.16 1 0 "[ . 1 . 2]"
202 PSI 2 81 LEU N 2 81 LEU CA 2 81 LEU C 2 82 ALA N -47.00 -25.00 -30.34 -47.35 -24.63 0.37 19 0 "[ . 1 . 2]"
203 PHI 2 81 LEU C 2 82 ALA N 2 82 ALA CA 2 82 ALA C -72.00 -52.00 -60.18 -64.61 -65.71 . . 0 "[ . 1 . 2]"
204 PSI 2 82 ALA N 2 82 ALA CA 2 82 ALA C 2 83 ASN N -47.00 -25.00 -35.91 -39.59 -40.94 2.04 3 0 "[ . 1 . 2]"
205 PHI 2 82 ALA C 2 83 ASN N 2 83 ASN CA 2 83 ASN C -87.00 -61.00 -71.88 -75.10 -77.35 0.59 3 0 "[ . 1 . 2]"
206 PSI 2 83 ASN N 2 83 ASN CA 2 83 ASN C 2 84 HIS N -30.00 4.00 -5.49 -25.22 4.28 0.28 16 0 "[ . 1 . 2]"
207 PHI 2 84 HIS C 2 85 GLY N 2 85 GLY CA 2 85 GLY C 69.00 103.00 93.43 78.45 104.41 1.41 17 0 "[ . 1 . 2]"
208 PSI 2 85 GLY N 2 85 GLY CA 2 85 GLY C 2 86 ILE N -4.00 22.00 15.95 13.01 9.60 2.88 17 0 "[ . 1 . 2]"
209 PHI 2 85 GLY C 2 86 ILE N 2 86 ILE CA 2 86 ILE C -100.00 -72.00 -98.62 -95.62 -99.96 1.60 20 0 "[ . 1 . 2]"
210 PSI 2 86 ILE N 2 86 ILE CA 2 86 ILE C 2 87 ASP N 118.00 146.00 131.99 120.36 140.33 . . 0 "[ . 1 . 2]"
211 PHI 2 86 ILE C 2 87 ASP N 2 87 ASP CA 2 87 ASP C -102.00 -68.00 -96.32 -88.23 -92.33 1.72 5 0 "[ . 1 . 2]"
212 PSI 2 87 ASP N 2 87 ASP CA 2 87 ASP C 2 88 ILE N 120.00 150.00 120.05 117.81 131.91 2.19 6 0 "[ . 1 . 2]"
213 PHI 2 87 ASP C 2 88 ILE N 2 88 ILE CA 2 88 ILE C -124.00 -90.00 -115.74 -113.97 -114.92 0.66 17 0 "[ . 1 . 2]"
214 PSI 2 88 ILE N 2 88 ILE CA 2 88 ILE C 2 89 LYS N 111.00 149.00 145.70 132.30 150.88 1.88 20 0 "[ . 1 . 2]"
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