NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
542480 |
2lsj   |
18433 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2lsj
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 195
_TA_constraint_stats_list.Viol_count 708
_TA_constraint_stats_list.Viol_total 11149.90
_TA_constraint_stats_list.Viol_max 4.78
_TA_constraint_stats_list.Viol_rms 0.51
_TA_constraint_stats_list.Viol_average_all_restraints 0.14
_TA_constraint_stats_list.Viol_average_violations_only 0.79
_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 23 ALA C 1 24 ALA N 1 24 ALA CA 1 24 ALA C -120.20 -37.20 -107.36 -120.37 -70.61 0.17 18 0 "[ . 1 . 2]"
2 PSI 1 24 ALA N 1 24 ALA CA 1 24 ALA C 1 25 PRO N 127.10 168.70 160.16 160.12 159.93 . . 0 "[ . 1 . 2]"
3 PHI 1 25 PRO C 1 26 ASN N 1 26 ASN CA 1 26 ASN C -159.00 -77.10 -124.09 -120.58 -123.65 . . 0 "[ . 1 . 2]"
4 PSI 1 26 ASN N 1 26 ASN CA 1 26 ASN C 1 27 LEU N 135.30 162.90 140.29 135.08 151.43 0.22 11 0 "[ . 1 . 2]"
5 PHI 1 26 ASN C 1 27 LEU N 1 27 LEU CA 1 27 LEU C -147.00 -75.00 -104.54 -110.38 -96.43 . . 0 "[ . 1 . 2]"
6 PSI 1 27 LEU N 1 27 LEU CA 1 27 LEU C 1 28 ALA N 99.00 177.00 112.36 113.39 112.94 . . 0 "[ . 1 . 2]"
7 PHI 1 28 ALA C 1 29 GLY N 1 29 GLY CA 1 29 GLY C 75.00 95.00 92.91 95.03 94.97 0.13 11 0 "[ . 1 . 2]"
8 PSI 1 29 GLY N 1 29 GLY CA 1 29 GLY C 1 30 ALA N -27.00 13.00 10.92 -7.88 13.15 0.15 16 0 "[ . 1 . 2]"
9 PHI 1 29 GLY C 1 30 ALA N 1 30 ALA CA 1 30 ALA C -167.00 41.00 -104.50 -108.44 -110.58 . . 0 "[ . 1 . 2]"
10 PSI 1 30 ALA N 1 30 ALA CA 1 30 ALA C 1 31 VAL N 110.10 -178.00 114.98 113.87 113.70 0.25 20 0 "[ . 1 . 2]"
11 PHI 1 31 VAL C 1 32 GLU N 1 32 GLU CA 1 32 GLU C -101.00 -47.40 -72.21 -82.83 -66.47 . . 0 "[ . 1 . 2]"
12 PSI 1 32 GLU N 1 32 GLU CA 1 32 GLU C 1 33 PHE N 98.50 180.00 141.82 133.91 148.03 . . 0 "[ . 1 . 2]"
13 PHI 1 32 GLU C 1 33 PHE N 1 33 PHE CA 1 33 PHE C -67.20 -41.30 -57.59 -57.79 -58.53 . . 0 "[ . 1 . 2]"
14 PSI 1 33 PHE N 1 33 PHE CA 1 33 PHE C 1 34 SER N -58.00 -29.10 -51.41 -53.67 -49.54 . . 0 "[ . 1 . 2]"
15 PHI 1 33 PHE C 1 34 SER N 1 34 SER CA 1 34 SER C -76.20 -40.70 -51.68 -52.28 -50.31 . . 0 "[ . 1 . 2]"
16 PSI 1 34 SER N 1 34 SER CA 1 34 SER C 1 35 ASP N -56.40 -29.60 -36.98 -36.60 -36.96 . . 0 "[ . 1 . 2]"
17 PHI 1 34 SER C 1 35 ASP N 1 35 ASP CA 1 35 ASP C -86.00 -46.00 -74.41 -80.27 -72.59 . . 0 "[ . 1 . 2]"
18 PSI 1 35 ASP N 1 35 ASP CA 1 35 ASP C 1 36 VAL N -49.70 -29.70 -30.20 -30.56 -31.49 0.29 16 0 "[ . 1 . 2]"
19 PHI 1 35 ASP C 1 36 VAL N 1 36 VAL CA 1 36 VAL C -73.40 -53.40 -71.39 -73.54 -64.81 0.14 17 0 "[ . 1 . 2]"
20 PSI 1 36 VAL N 1 36 VAL CA 1 36 VAL C 1 37 LYS N -57.10 -27.10 -56.18 -57.25 -57.36 0.31 1 0 "[ . 1 . 2]"
21 PHI 1 36 VAL C 1 37 LYS N 1 37 LYS CA 1 37 LYS C -72.30 -52.30 -56.88 -63.48 -53.28 . . 0 "[ . 1 . 2]"
22 PSI 1 37 LYS N 1 37 LYS CA 1 37 LYS C 1 38 THR N -56.10 -30.60 -32.36 -30.57 -31.03 0.23 4 0 "[ . 1 . 2]"
23 PHI 1 37 LYS C 1 38 THR N 1 38 THR CA 1 38 THR C -84.80 -47.90 -65.94 -65.92 -67.04 . . 0 "[ . 1 . 2]"
24 PSI 1 38 THR N 1 38 THR CA 1 38 THR C 1 39 LEU N -54.00 -28.30 -39.88 -45.95 -36.87 . . 0 "[ . 1 . 2]"
25 PHI 1 38 THR C 1 39 LEU N 1 39 LEU CA 1 39 LEU C -70.40 -50.40 -68.94 -67.31 -68.13 0.12 16 0 "[ . 1 . 2]"
26 PSI 1 39 LEU N 1 39 LEU CA 1 39 LEU C 1 40 LEU N -60.00 -29.50 -35.65 -32.95 -34.00 . . 0 "[ . 1 . 2]"
27 PHI 1 39 LEU C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -71.80 -51.80 -71.87 -72.56 -68.15 0.76 3 0 "[ . 1 . 2]"
28 PSI 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 LYS N -54.40 -27.60 -46.62 -49.98 -44.14 . . 0 "[ . 1 . 2]"
29 PHI 1 40 LEU C 1 41 LYS N 1 41 LYS CA 1 41 LYS C -73.80 -53.80 -52.70 -52.77 -52.82 1.80 7 0 "[ . 1 . 2]"
30 PSI 1 41 LYS N 1 41 LYS CA 1 41 LYS C 1 42 GLU N -47.60 -27.60 -43.17 -43.70 -44.37 . . 0 "[ . 1 . 2]"
31 PHI 1 41 LYS C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -77.00 -53.70 -77.18 -77.50 -75.91 0.50 10 0 "[ . 1 . 2]"
32 PSI 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 TRP N -57.40 -31.50 -41.36 -41.98 -42.01 . . 0 "[ . 1 . 2]"
33 PHI 1 42 GLU C 1 43 TRP N 1 43 TRP CA 1 43 TRP C -77.10 -53.20 -63.91 -70.36 -63.06 . . 0 "[ . 1 . 2]"
34 PSI 1 43 TRP N 1 43 TRP CA 1 43 TRP C 1 44 ILE N -56.40 -12.80 -15.07 -15.72 -14.13 . . 0 "[ . 1 . 2]"
35 PHI 1 43 TRP C 1 44 ILE N 1 44 ILE CA 1 44 ILE C -106.20 -36.80 -102.49 -106.16 -101.47 . . 0 "[ . 1 . 2]"
36 PSI 1 44 ILE N 1 44 ILE CA 1 44 ILE C 1 45 THR N -62.00 5.80 -12.68 -12.78 -13.08 0.58 3 0 "[ . 1 . 2]"
37 PHI 1 44 ILE C 1 45 THR N 1 45 THR CA 1 45 THR C -124.10 -39.80 -104.29 -122.35 -100.04 . . 0 "[ . 1 . 2]"
38 PSI 1 45 THR N 1 45 THR CA 1 45 THR C 1 46 THR N -54.70 15.40 -55.80 -55.52 -55.67 1.54 11 0 "[ . 1 . 2]"
39 PHI 1 45 THR C 1 46 THR N 1 46 THR CA 1 46 THR C -139.40 -52.40 -66.90 -74.47 -64.78 . . 0 "[ . 1 . 2]"
40 PSI 1 46 THR N 1 46 THR CA 1 46 THR C 1 47 ILE N -48.30 2.80 -15.96 -19.03 -6.92 . . 0 "[ . 1 . 2]"
41 CHI1 1 46 THR N 1 46 THR CA 1 46 THR CB 1 46 THR OG1 170.00 -170.00 -169.20 -169.15 -169.25 1.07 16 0 "[ . 1 . 2]"
42 PHI 1 46 THR C 1 47 ILE N 1 47 ILE CA 1 47 ILE C -160.00 -60.30 -128.88 -128.18 -128.76 . . 0 "[ . 1 . 2]"
43 PSI 1 47 ILE N 1 47 ILE CA 1 47 ILE C 1 48 SER N -0.90 -139.80 128.39 125.44 133.98 . . 0 "[ . 1 . 2]"
44 PHI 1 47 ILE C 1 48 SER N 1 48 SER CA 1 48 SER C -106.60 -52.40 -106.97 -106.87 -106.87 0.88 13 0 "[ . 1 . 2]"
45 PSI 1 48 SER N 1 48 SER CA 1 48 SER C 1 49 ASP N -62.30 0.20 -26.69 -33.11 -24.24 . . 0 "[ . 1 . 2]"
46 PHI 1 48 SER C 1 49 ASP N 1 49 ASP CA 1 49 ASP C -163.50 -71.70 -113.70 -118.91 -110.75 . . 0 "[ . 1 . 2]"
47 PSI 1 49 ASP N 1 49 ASP CA 1 49 ASP C 1 50 PRO N 73.80 -163.60 80.45 79.99 79.60 . . 0 "[ . 1 . 2]"
48 PHI 1 50 PRO C 1 51 MET N 1 51 MET CA 1 51 MET C -130.00 -50.70 -94.19 -106.25 -82.07 . . 0 "[ . 1 . 2]"
49 PSI 1 51 MET N 1 51 MET CA 1 51 MET C 1 52 GLU N 92.30 -171.20 158.35 148.02 172.23 . . 0 "[ . 1 . 2]"
50 PHI 1 51 MET C 1 52 GLU N 1 52 GLU CA 1 52 GLU C -65.20 -41.70 -56.10 -58.21 -60.43 . . 0 "[ . 1 . 2]"
51 PSI 1 52 GLU N 1 52 GLU CA 1 52 GLU C 1 53 GLU N -74.70 -14.70 -43.20 -34.16 -34.70 . . 0 "[ . 1 . 2]"
52 PHI 1 52 GLU C 1 53 GLU N 1 53 GLU CA 1 53 GLU C -71.80 -51.80 -62.05 -71.89 -51.66 0.14 20 0 "[ . 1 . 2]"
53 PSI 1 53 GLU N 1 53 GLU CA 1 53 GLU C 1 54 ASP N -57.10 -26.00 -44.69 -51.51 -30.58 . . 0 "[ . 1 . 2]"
54 PHI 1 53 GLU C 1 54 ASP N 1 54 ASP CA 1 54 ASP C -76.00 -55.30 -60.36 -58.22 -61.58 0.23 11 0 "[ . 1 . 2]"
55 PSI 1 54 ASP N 1 54 ASP CA 1 54 ASP C 1 55 ILE N -51.30 -31.30 -45.97 -51.44 -34.09 0.14 6 0 "[ . 1 . 2]"
56 PHI 1 54 ASP C 1 55 ILE N 1 55 ILE CA 1 55 ILE C -72.70 -52.70 -67.34 -63.16 -63.87 0.09 11 0 "[ . 1 . 2]"
57 PSI 1 55 ILE N 1 55 ILE CA 1 55 ILE C 1 56 LEU N -59.20 -30.70 -35.79 -49.93 -30.41 0.29 1 0 "[ . 1 . 2]"
58 PHI 1 55 ILE C 1 56 LEU N 1 56 LEU CA 1 56 LEU C -81.10 -49.90 -59.80 -64.65 -64.74 0.11 11 0 "[ . 1 . 2]"
59 PSI 1 56 LEU N 1 56 LEU CA 1 56 LEU C 1 57 GLN N -48.60 -28.60 -38.23 -41.23 -28.29 0.31 11 0 "[ . 1 . 2]"
60 PHI 1 56 LEU C 1 57 GLN N 1 57 GLN CA 1 57 GLN C -74.10 -54.10 -54.37 -56.36 -53.87 0.23 8 0 "[ . 1 . 2]"
61 PSI 1 57 GLN N 1 57 GLN CA 1 57 GLN C 1 58 VAL N -51.40 -29.20 -31.93 -29.97 -30.59 . . 0 "[ . 1 . 2]"
62 PHI 1 57 GLN C 1 58 VAL N 1 58 VAL CA 1 58 VAL C -73.20 -53.20 -72.17 -73.46 -70.43 0.26 18 0 "[ . 1 . 2]"
63 PSI 1 58 VAL N 1 58 VAL CA 1 58 VAL C 1 59 VAL N -54.80 -34.80 -34.58 -34.78 -34.87 3.80 11 0 "[ . 1 . 2]"
64 PHI 1 58 VAL C 1 59 VAL N 1 59 VAL CA 1 59 VAL C -74.90 -52.30 -64.46 -67.96 -59.10 . . 0 "[ . 1 . 2]"
65 PSI 1 59 VAL N 1 59 VAL CA 1 59 VAL C 1 60 ARG N -52.90 -29.30 -51.18 -47.87 -49.92 . . 0 "[ . 1 . 2]"
66 PHI 1 59 VAL C 1 60 ARG N 1 60 ARG CA 1 60 ARG C -73.70 -53.70 -59.69 -62.14 -58.34 . . 0 "[ . 1 . 2]"
67 PSI 1 60 ARG N 1 60 ARG CA 1 60 ARG C 1 61 TYR N -59.20 -17.80 -26.76 -32.41 -25.24 . . 0 "[ . 1 . 2]"
68 PHI 1 60 ARG C 1 61 TYR N 1 61 TYR CA 1 61 TYR C -75.30 -49.40 -74.78 -72.28 -74.71 0.32 10 0 "[ . 1 . 2]"
69 PSI 1 61 TYR N 1 61 TYR CA 1 61 TYR C 1 62 CYS N -57.50 -37.10 -52.49 -50.34 -51.84 . . 0 "[ . 1 . 2]"
70 PHI 1 61 TYR C 1 62 CYS N 1 62 CYS CA 1 62 CYS C -77.10 -53.50 -66.76 -68.62 -64.77 . . 0 "[ . 1 . 2]"
71 PSI 1 62 CYS N 1 62 CYS CA 1 62 CYS C 1 63 THR N -55.30 -22.70 -45.36 -47.30 -43.28 . . 0 "[ . 1 . 2]"
72 PHI 1 62 CYS C 1 63 THR N 1 63 THR CA 1 63 THR C -86.80 -52.00 -55.86 -59.64 -52.84 . . 0 "[ . 1 . 2]"
73 PSI 1 63 THR N 1 63 THR CA 1 63 THR C 1 64 ASP N -54.50 -18.90 -27.31 -25.55 -26.01 . . 0 "[ . 1 . 2]"
74 PHI 1 63 THR C 1 64 ASP N 1 64 ASP CA 1 64 ASP C -73.00 -53.00 -73.77 -74.21 -73.34 1.21 5 0 "[ . 1 . 2]"
75 PSI 1 64 ASP N 1 64 ASP CA 1 64 ASP C 1 65 LEU N -51.20 -31.20 -37.45 -36.73 -36.88 . . 0 "[ . 1 . 2]"
76 PHI 1 64 ASP C 1 65 LEU N 1 65 LEU CA 1 65 LEU C -74.50 -54.50 -54.51 -58.57 -53.86 0.64 7 0 "[ . 1 . 2]"
77 PSI 1 65 LEU N 1 65 LEU CA 1 65 LEU C 1 66 ILE N -50.70 -30.70 -33.78 -38.05 -30.56 0.14 7 0 "[ . 1 . 2]"
78 PHI 1 65 LEU C 1 66 ILE N 1 66 ILE CA 1 66 ILE C -75.80 -55.80 -64.05 -62.53 -63.35 . . 0 "[ . 1 . 2]"
79 PSI 1 66 ILE N 1 66 ILE CA 1 66 ILE C 1 67 GLU N -49.50 -27.70 -47.20 -45.20 -45.73 0.14 19 0 "[ . 1 . 2]"
80 PHI 1 66 ILE C 1 67 GLU N 1 67 GLU CA 1 67 GLU C -72.50 -52.50 -73.66 -73.73 -73.79 1.76 20 0 "[ . 1 . 2]"
81 PSI 1 67 GLU N 1 67 GLU CA 1 67 GLU C 1 68 GLU N -50.40 -10.80 -31.72 -36.62 -23.91 . . 0 "[ . 1 . 2]"
82 PHI 1 67 GLU C 1 68 GLU N 1 68 GLU CA 1 68 GLU C -111.00 -74.10 -84.87 -90.85 -81.83 . . 0 "[ . 1 . 2]"
83 PSI 1 68 GLU N 1 68 GLU CA 1 68 GLU C 1 69 LYS N -18.40 30.30 -7.93 -2.82 -7.31 . . 0 "[ . 1 . 2]"
84 PHI 1 70 ASP C 1 71 LEU N 1 71 LEU CA 1 71 LEU C -78.20 -49.40 -55.08 -51.95 -53.14 . . 0 "[ . 1 . 2]"
85 PSI 1 71 LEU N 1 71 LEU CA 1 71 LEU C 1 72 GLU N -54.20 -2.50 -21.49 -24.41 -24.88 . . 0 "[ . 1 . 2]"
86 PHI 1 71 LEU C 1 72 GLU N 1 72 GLU CA 1 72 GLU C -71.00 -51.00 -50.23 -49.96 -50.15 1.15 6 0 "[ . 1 . 2]"
87 PSI 1 72 GLU N 1 72 GLU CA 1 72 GLU C 1 73 LYS N -54.90 -34.10 -50.71 -45.49 -46.18 0.80 4 0 "[ . 1 . 2]"
88 PHI 1 72 GLU C 1 73 LYS N 1 73 LYS CA 1 73 LYS C -78.00 -48.00 -78.83 -79.41 -78.56 1.41 2 0 "[ . 1 . 2]"
89 PSI 1 73 LYS N 1 73 LYS CA 1 73 LYS C 1 74 LEU N -56.90 -22.90 -22.71 -24.47 -22.14 0.76 12 0 "[ . 1 . 2]"
90 PHI 1 73 LYS C 1 74 LEU N 1 74 LEU CA 1 74 LEU C -71.90 -51.90 -56.45 -55.78 -57.36 . . 0 "[ . 1 . 2]"
91 PSI 1 74 LEU N 1 74 LEU CA 1 74 LEU C 1 75 ASP N -62.00 -22.80 -57.87 -60.73 -61.72 0.18 1 0 "[ . 1 . 2]"
92 PHI 1 74 LEU C 1 75 ASP N 1 75 ASP CA 1 75 ASP C -76.80 -49.50 -57.35 -54.27 -54.58 . . 0 "[ . 1 . 2]"
93 PSI 1 75 ASP N 1 75 ASP CA 1 75 ASP C 1 76 LEU N -65.70 -25.80 -27.39 -29.26 -26.43 . . 0 "[ . 1 . 2]"
94 PHI 1 75 ASP C 1 76 LEU N 1 76 LEU CA 1 76 LEU C -76.50 -50.40 -76.72 -76.90 -76.93 0.47 14 0 "[ . 1 . 2]"
95 PSI 1 76 LEU N 1 76 LEU CA 1 76 LEU C 1 77 VAL N -58.30 -24.60 -45.26 -52.27 -39.83 . . 0 "[ . 1 . 2]"
96 PHI 1 76 LEU C 1 77 VAL N 1 77 VAL CA 1 77 VAL C -74.90 -54.90 -69.87 -70.79 -71.03 . . 0 "[ . 1 . 2]"
97 PSI 1 77 VAL N 1 77 VAL CA 1 77 VAL C 1 78 ILE N -54.40 -30.70 -39.18 -40.55 -42.05 . . 0 "[ . 1 . 2]"
98 PHI 1 77 VAL C 1 78 ILE N 1 78 ILE CA 1 78 ILE C -76.00 -56.00 -64.50 -70.27 -55.83 0.17 6 0 "[ . 1 . 2]"
99 PSI 1 78 ILE N 1 78 ILE CA 1 78 ILE C 1 79 LYS N -57.30 -30.40 -55.22 -57.79 -52.36 0.49 2 0 "[ . 1 . 2]"
100 PHI 1 78 ILE C 1 79 LYS N 1 79 LYS CA 1 79 LYS C -73.00 -53.00 -63.08 -61.46 -61.83 . . 0 "[ . 1 . 2]"
101 PSI 1 79 LYS N 1 79 LYS CA 1 79 LYS C 1 80 TYR N -53.10 -28.40 -28.46 -33.07 -34.27 3.40 12 0 "[ . 1 . 2]"
102 PHI 1 79 LYS C 1 80 TYR N 1 80 TYR CA 1 80 TYR C -83.20 -48.40 -74.84 -81.13 -62.59 . . 0 "[ . 1 . 2]"
103 PSI 1 80 TYR N 1 80 TYR CA 1 80 TYR C 1 81 MET N -56.40 -36.40 -47.84 -56.72 -43.26 0.32 5 0 "[ . 1 . 2]"
104 PHI 1 80 TYR C 1 81 MET N 1 81 MET CA 1 81 MET C -72.80 -50.80 -70.61 -63.93 -65.77 2.15 7 0 "[ . 1 . 2]"
105 PSI 1 81 MET N 1 81 MET CA 1 81 MET C 1 82 LYS N -49.60 -28.20 -30.29 -27.38 -27.42 1.53 9 0 "[ . 1 . 2]"
106 PHI 1 81 MET C 1 82 LYS N 1 82 LYS CA 1 82 LYS C -85.40 -42.10 -67.07 -61.39 -61.76 . . 0 "[ . 1 . 2]"
107 PSI 1 82 LYS N 1 82 LYS CA 1 82 LYS C 1 83 ARG N -59.10 -34.70 -42.22 -57.48 -57.61 3.03 17 0 "[ . 1 . 2]"
108 PHI 1 82 LYS C 1 83 ARG N 1 83 ARG CA 1 83 ARG C -76.10 -47.20 -64.40 -73.04 -52.12 . . 0 "[ . 1 . 2]"
109 PSI 1 83 ARG N 1 83 ARG CA 1 83 ARG C 1 84 LEU N -57.30 -23.80 -28.31 -26.35 -26.84 . . 0 "[ . 1 . 2]"
110 PHI 1 83 ARG C 1 84 LEU N 1 84 LEU CA 1 84 LEU C -81.60 -52.50 -82.00 -82.67 -80.72 1.07 16 0 "[ . 1 . 2]"
111 PSI 1 84 LEU N 1 84 LEU CA 1 84 LEU C 1 85 MET N -59.10 -22.30 -54.44 -53.96 -54.07 . . 0 "[ . 1 . 2]"
112 PHI 1 84 LEU C 1 85 MET N 1 85 MET CA 1 85 MET C -76.00 -46.30 -58.21 -63.31 -54.34 . . 0 "[ . 1 . 2]"
113 PSI 1 85 MET N 1 85 MET CA 1 85 MET C 1 86 GLN N -55.60 -26.20 -27.80 -26.61 -27.28 0.27 2 0 "[ . 1 . 2]"
114 PHI 1 85 MET C 1 86 GLN N 1 86 GLN CA 1 86 GLN C -87.10 -52.90 -79.66 -83.32 -77.26 . . 0 "[ . 1 . 2]"
115 PSI 1 86 GLN N 1 86 GLN CA 1 86 GLN C 1 87 GLN N -57.00 5.90 -49.00 -48.49 -50.00 . . 0 "[ . 1 . 2]"
116 PHI 1 86 GLN C 1 87 GLN N 1 87 GLN CA 1 87 GLN C -106.50 -38.70 -72.73 -88.68 -62.56 . . 0 "[ . 1 . 2]"
117 PSI 1 87 GLN N 1 87 GLN CA 1 87 GLN C 1 88 SER N -66.20 17.50 -10.47 -10.61 -13.54 . . 0 "[ . 1 . 2]"
118 PHI 1 90 GLU C 1 91 SER N 1 91 SER CA 1 91 SER C -71.60 -46.80 -67.43 -61.84 -66.82 0.17 11 0 "[ . 1 . 2]"
119 PSI 1 91 SER N 1 91 SER CA 1 91 SER C 1 92 VAL N -51.70 -4.50 -24.73 -19.33 -23.62 . . 0 "[ . 1 . 2]"
120 PHI 1 91 SER C 1 92 VAL N 1 92 VAL CA 1 92 VAL C -117.50 -38.60 -56.63 -61.11 -54.24 . . 0 "[ . 1 . 2]"
121 PSI 1 92 VAL N 1 92 VAL CA 1 92 VAL C 1 93 TRP N -66.60 -8.40 -26.90 -32.06 -22.85 . . 0 "[ . 1 . 2]"
122 PHI 1 92 VAL C 1 93 TRP N 1 93 TRP CA 1 93 TRP C -76.20 -56.20 -65.58 -61.85 -62.71 . . 0 "[ . 1 . 2]"
123 PSI 1 93 TRP N 1 93 TRP CA 1 93 TRP C 1 94 ASN N -53.10 -23.30 -35.10 -38.79 -27.09 . . 0 "[ . 1 . 2]"
124 PHI 1 93 TRP C 1 94 ASN N 1 94 ASN CA 1 94 ASN C -72.90 -41.30 -58.18 -66.36 -55.69 . . 0 "[ . 1 . 2]"
125 PSI 1 94 ASN N 1 94 ASN CA 1 94 ASN C 1 95 MET N -60.40 -27.10 -39.21 -35.91 -37.09 . . 0 "[ . 1 . 2]"
126 PHI 1 94 ASN C 1 95 MET N 1 95 MET CA 1 95 MET C -72.40 -52.40 -72.43 -72.83 -70.80 0.43 8 0 "[ . 1 . 2]"
127 PSI 1 95 MET N 1 95 MET CA 1 95 MET C 1 96 ALA N -49.10 -29.10 -37.68 -41.26 -31.57 . . 0 "[ . 1 . 2]"
128 PHI 1 95 MET C 1 96 ALA N 1 96 ALA CA 1 96 ALA C -73.20 -53.20 -53.84 -52.95 -53.03 0.25 2 0 "[ . 1 . 2]"
129 PSI 1 96 ALA N 1 96 ALA CA 1 96 ALA C 1 97 PHE N -53.80 -33.80 -43.02 -40.04 -40.79 . . 0 "[ . 1 . 2]"
130 PHI 1 96 ALA C 1 97 PHE N 1 97 PHE CA 1 97 PHE C -71.60 -50.70 -59.63 -64.56 -55.25 . . 0 "[ . 1 . 2]"
131 PSI 1 97 PHE N 1 97 PHE CA 1 97 PHE C 1 98 ASP N -66.20 -25.90 -46.23 -55.06 -38.86 . . 0 "[ . 1 . 2]"
132 PHI 1 97 PHE C 1 98 ASP N 1 98 ASP CA 1 98 ASP C -68.80 -48.80 -63.92 -63.32 -64.57 0.01 8 0 "[ . 1 . 2]"
133 PSI 1 98 ASP N 1 98 ASP CA 1 98 ASP C 1 99 PHE N -58.90 -22.40 -36.36 -41.33 -33.61 . . 0 "[ . 1 . 2]"
134 PHI 1 98 ASP C 1 99 PHE N 1 99 PHE CA 1 99 PHE C -74.50 -54.50 -58.14 -60.66 -54.61 . . 0 "[ . 1 . 2]"
135 PSI 1 99 PHE N 1 99 PHE CA 1 99 PHE C 1 100 ILE N -54.90 -29.70 -46.63 -49.04 -42.75 . . 0 "[ . 1 . 2]"
136 PHI 1 99 PHE C 1 100 ILE N 1 100 ILE CA 1 100 ILE C -88.50 -44.60 -65.91 -65.66 -66.67 . . 0 "[ . 1 . 2]"
137 PSI 1 100 ILE N 1 100 ILE CA 1 100 ILE C 1 101 LEU N -60.30 -18.90 -40.59 -38.51 -39.02 . . 0 "[ . 1 . 2]"
138 PHI 1 100 ILE C 1 101 LEU N 1 101 LEU CA 1 101 LEU C -77.80 -49.70 -67.74 -71.49 -59.79 . . 0 "[ . 1 . 2]"
139 PSI 1 101 LEU N 1 101 LEU CA 1 101 LEU C 1 102 ASP N -55.00 -27.00 -34.19 -33.68 -33.86 . . 0 "[ . 1 . 2]"
140 PHI 1 101 LEU C 1 102 ASP N 1 102 ASP CA 1 102 ASP C -71.70 -51.70 -60.06 -62.28 -58.15 . . 0 "[ . 1 . 2]"
141 PSI 1 102 ASP N 1 102 ASP CA 1 102 ASP C 1 103 ASN N -51.00 -23.30 -27.60 -26.69 -26.79 . . 0 "[ . 1 . 2]"
142 PHI 1 102 ASP C 1 103 ASN N 1 103 ASN CA 1 103 ASN C -94.00 -34.00 -98.14 -98.78 -97.41 4.78 13 0 "[ . 1 . 2]"
143 PSI 1 103 ASN N 1 103 ASN CA 1 103 ASN C 1 104 VAL N -57.80 -28.20 -38.59 -39.66 -40.41 . . 0 "[ . 1 . 2]"
144 PHI 1 103 ASN C 1 104 VAL N 1 104 VAL CA 1 104 VAL C -77.00 -47.00 -73.51 -77.11 -71.14 0.11 10 0 "[ . 1 . 2]"
145 PSI 1 104 VAL N 1 104 VAL CA 1 104 VAL C 1 105 GLN N -63.20 -26.70 -59.53 -58.74 -58.88 . . 0 "[ . 1 . 2]"
146 PHI 1 104 VAL C 1 105 GLN N 1 105 GLN CA 1 105 GLN C -70.50 -49.60 -49.12 -49.07 -49.18 0.84 13 0 "[ . 1 . 2]"
147 PSI 1 105 GLN N 1 105 GLN CA 1 105 GLN C 1 106 VAL N -55.30 -29.70 -29.29 -29.94 -28.79 0.91 18 0 "[ . 1 . 2]"
148 PHI 1 105 GLN C 1 106 VAL N 1 106 VAL CA 1 106 VAL C -79.00 -54.50 -70.91 -72.09 -69.29 . . 0 "[ . 1 . 2]"
149 PSI 1 106 VAL N 1 106 VAL CA 1 106 VAL C 1 107 VAL N -57.30 -36.30 -55.39 -55.95 -56.15 . . 0 "[ . 1 . 2]"
150 PHI 1 106 VAL C 1 107 VAL N 1 107 VAL CA 1 107 VAL C -73.30 -53.30 -66.13 -68.97 -63.95 . . 0 "[ . 1 . 2]"
151 PSI 1 107 VAL N 1 107 VAL CA 1 107 VAL C 1 108 LEU N -56.80 -25.30 -25.66 -26.71 -24.79 0.51 20 0 "[ . 1 . 2]"
152 PHI 1 107 VAL C 1 108 LEU N 1 108 LEU CA 1 108 LEU C -73.30 -51.30 -74.15 -74.41 -73.65 1.11 4 0 "[ . 1 . 2]"
153 PSI 1 108 LEU N 1 108 LEU CA 1 108 LEU C 1 109 GLN N -62.20 -25.00 -38.89 -39.37 -38.40 . . 0 "[ . 1 . 2]"
154 PHI 1 108 LEU C 1 109 GLN N 1 109 GLN CA 1 109 GLN C -73.80 -53.80 -66.63 -67.09 -67.10 . . 0 "[ . 1 . 2]"
155 PSI 1 109 GLN N 1 109 GLN CA 1 109 GLN C 1 110 GLN N -52.30 -28.80 -41.12 -40.89 -41.00 . . 0 "[ . 1 . 2]"
156 PHI 1 109 GLN C 1 110 GLN N 1 110 GLN CA 1 110 GLN C -78.50 -55.40 -64.01 -64.73 -63.20 . . 0 "[ . 1 . 2]"
157 PSI 1 110 GLN N 1 110 GLN CA 1 110 GLN C 1 111 THR N -56.00 -8.20 -15.04 -15.84 -14.39 . . 0 "[ . 1 . 2]"
158 PHI 1 110 GLN C 1 111 THR N 1 111 THR CA 1 111 THR C -94.00 -46.00 -95.68 -95.77 -95.81 2.13 6 0 "[ . 1 . 2]"
159 PSI 1 111 THR N 1 111 THR CA 1 111 THR C 1 112 TYR N -60.80 -1.30 -60.27 -60.95 -58.98 0.15 7 0 "[ . 1 . 2]"
160 PHI 1 111 THR C 1 112 TYR N 1 112 TYR CA 1 112 TYR C -106.10 -71.70 -103.02 -102.54 -102.66 . . 0 "[ . 1 . 2]"
161 PSI 1 112 TYR N 1 112 TYR CA 1 112 TYR C 1 113 GLY N -39.60 11.00 -42.87 -42.50 -42.59 3.70 17 0 "[ . 1 . 2]"
162 PHI 1 112 TYR C 1 113 GLY N 1 113 GLY CA 1 113 GLY C 45.00 111.00 110.67 104.98 111.86 0.86 3 0 "[ . 1 . 2]"
163 PSI 1 113 GLY N 1 113 GLY CA 1 113 GLY C 1 114 SER N -14.00 42.00 -9.44 -14.52 -14.53 0.61 11 0 "[ . 1 . 2]"
164 PHI 1 113 GLY C 1 114 SER N 1 114 SER CA 1 114 SER C -164.40 -37.50 -99.28 -93.06 -93.21 . . 0 "[ . 1 . 2]"
165 PSI 1 114 SER N 1 114 SER CA 1 114 SER C 1 115 THR N 139.30 -172.80 -175.10 178.31 -172.53 0.27 19 0 "[ . 1 . 2]"
166 PHI 1 114 SER C 1 115 THR N 1 115 THR CA 1 115 THR C 168.10 -45.30 -152.50 -152.53 -152.56 . . 0 "[ . 1 . 2]"
167 PSI 1 115 THR N 1 115 THR CA 1 115 THR C 1 116 LEU N 115.70 -178.00 176.99 145.01 -177.63 0.37 20 0 "[ . 1 . 2]"
168 PHI 1 115 THR C 1 116 LEU N 1 116 LEU CA 1 116 LEU C -106.20 -48.30 -88.61 -93.12 -93.75 . . 0 "[ . 1 . 2]"
169 PSI 1 116 LEU N 1 116 LEU CA 1 116 LEU C 1 117 LYS N 119.60 155.40 149.81 136.77 155.88 0.48 8 0 "[ . 1 . 2]"
170 PHI 1 116 LEU C 1 117 LYS N 1 117 LYS CA 1 117 LYS C -159.60 -42.80 -97.91 -79.67 -86.08 . . 0 "[ . 1 . 2]"
171 PSI 1 117 LYS N 1 117 LYS CA 1 117 LYS C 1 118 VAL N 96.10 172.20 98.35 95.24 102.52 0.86 12 0 "[ . 1 . 2]"
172 PHI 1 117 LYS C 1 118 VAL N 1 118 VAL CA 1 118 VAL C -117.70 -53.40 -117.47 -119.01 -111.12 1.31 11 0 "[ . 1 . 2]"
173 PSI 1 118 VAL N 1 118 VAL CA 1 118 VAL C 1 119 THR N 72.30 -175.20 97.93 87.41 111.25 . . 0 "[ . 1 . 2]"
174 PHI 1 118 VAL C 1 119 THR N 1 119 THR CA 1 119 THR C -142.00 -38.90 -62.56 -111.44 -51.07 . . 0 "[ . 1 . 2]"
175 PSI 2 7 LYS N 2 7 LYS CA 2 7 LYS C 2 8 SER N 62.00 -142.00 131.17 66.71 177.98 . . 0 "[ . 1 . 2]"
176 PHI 2 8 SER C 2 9 PHE N 2 9 PHE CA 2 9 PHE C -90.70 -40.80 -66.63 -82.58 -51.95 . . 0 "[ . 1 . 2]"
177 PSI 2 9 PHE N 2 9 PHE CA 2 9 PHE C 2 10 PHE N -59.70 -0.70 -44.44 -58.62 -34.35 . . 0 "[ . 1 . 2]"
178 PHI 2 9 PHE C 2 10 PHE N 2 10 PHE CA 2 10 PHE C -76.40 -56.40 -62.70 -61.83 -62.41 0.08 13 0 "[ . 1 . 2]"
179 PSI 2 10 PHE N 2 10 PHE CA 2 10 PHE C 2 11 ASP N -58.10 -16.60 -26.03 -24.68 -25.10 . . 0 "[ . 1 . 2]"
180 PHI 2 10 PHE C 2 11 ASP N 2 11 ASP CA 2 11 ASP C -76.60 -56.60 -74.89 -76.83 -71.64 0.23 7 0 "[ . 1 . 2]"
181 PSI 2 11 ASP N 2 11 ASP CA 2 11 ASP C 2 12 LYS N -47.20 -27.20 -44.67 -44.99 -46.48 0.03 6 0 "[ . 1 . 2]"
182 PHI 2 11 ASP C 2 12 LYS N 2 12 LYS CA 2 12 LYS C -77.30 -50.20 -75.32 -78.00 -67.94 0.70 9 0 "[ . 1 . 2]"
183 PSI 2 12 LYS N 2 12 LYS CA 2 12 LYS C 2 13 LYS N -62.40 -18.60 -21.93 -21.52 -22.66 0.36 9 0 "[ . 1 . 2]"
184 PHI 2 12 LYS C 2 13 LYS N 2 13 LYS CA 2 13 LYS C -94.60 -44.90 -84.50 -90.64 -77.92 . . 0 "[ . 1 . 2]"
185 PSI 2 13 LYS N 2 13 LYS CA 2 13 LYS C 2 14 ARG N -72.80 15.60 -45.39 -54.23 -34.29 . . 0 "[ . 1 . 2]"
186 PHI 2 13 LYS C 2 14 ARG N 2 14 ARG CA 2 14 ARG C -73.20 -53.20 -59.27 -58.06 -60.98 0.96 5 0 "[ . 1 . 2]"
187 PSI 2 14 ARG N 2 14 ARG CA 2 14 ARG C 2 15 SER N -58.00 -26.00 -28.80 -30.76 -31.76 1.34 5 0 "[ . 1 . 2]"
188 PHI 2 14 ARG C 2 15 SER N 2 15 SER CA 2 15 SER C -78.40 -47.60 -69.10 -70.26 -73.85 0.86 9 0 "[ . 1 . 2]"
189 PSI 2 15 SER N 2 15 SER CA 2 15 SER C 2 16 GLU N -61.70 -25.90 -38.78 -61.96 -25.68 0.26 3 0 "[ . 1 . 2]"
190 PHI 2 15 SER C 2 16 GLU N 2 16 GLU CA 2 16 GLU C -77.10 -53.90 -60.21 -62.69 -64.37 0.38 9 0 "[ . 1 . 2]"
191 PSI 2 16 GLU N 2 16 GLU CA 2 16 GLU C 2 17 ARG N -57.20 -30.70 -44.97 -57.30 -30.66 0.10 11 0 "[ . 1 . 2]"
192 PHI 2 16 GLU C 2 17 ARG N 2 17 ARG CA 2 17 ARG C -79.60 -51.90 -64.27 -65.74 -67.93 0.18 9 0 "[ . 1 . 2]"
193 PSI 2 17 ARG N 2 17 ARG CA 2 17 ARG C 2 18 ILE N -60.50 -14.10 -35.15 -48.42 -25.87 . . 0 "[ . 1 . 2]"
194 PHI 2 17 ARG C 2 18 ILE N 2 18 ILE CA 2 18 ILE C -117.90 -48.60 -70.47 -67.15 -68.97 . . 0 "[ . 1 . 2]"
195 PSI 2 18 ILE N 2 18 ILE CA 2 18 ILE C 2 19 SER N -62.80 10.80 -34.18 -26.67 -33.42 0.12 20 0 "[ . 1 . 2]"
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