NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
427561 |
2hm8   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2hm8
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 174
_TA_constraint_stats_list.Viol_count 1612
_TA_constraint_stats_list.Viol_total 38952.49
_TA_constraint_stats_list.Viol_max 4.57
_TA_constraint_stats_list.Viol_rms 0.37
_TA_constraint_stats_list.Viol_average_all_restraints 0.09
_TA_constraint_stats_list.Viol_average_violations_only 0.49
_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 12 ASN C 1 13 HIS N 1 13 HIS CA 1 13 HIS C -78.00 -46.00 -71.03 -80.99 -52.11 2.99 6 0 "[ . 1 . 2 . 3 . 4 . ]"
2 PSI 1 13 HIS N 1 13 HIS CA 1 13 HIS C 1 14 LEU N -53.00 -29.00 -43.14 -53.00 -29.23 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
3 PHI 1 13 HIS C 1 14 LEU N 1 14 LEU CA 1 14 LEU C -74.80 -54.80 -64.70 -57.88 -59.19 0.64 43 0 "[ . 1 . 2 . 3 . 4 . ]"
4 PSI 1 14 LEU N 1 14 LEU CA 1 14 LEU C 1 15 VAL N -49.20 -27.60 -35.45 -31.66 -32.10 0.51 23 0 "[ . 1 . 2 . 3 . 4 . ]"
5 PHI 1 14 LEU C 1 15 VAL N 1 15 VAL CA 1 15 VAL C -90.10 -45.90 -59.71 -77.55 -49.10 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
6 PSI 1 15 VAL N 1 15 VAL CA 1 15 VAL C 1 16 LYS N -53.50 -33.50 -40.54 -53.52 -31.10 2.40 43 0 "[ . 1 . 2 . 3 . 4 . ]"
7 PHI 1 15 VAL C 1 16 LYS N 1 16 LYS CA 1 16 LYS C -72.40 -49.80 -63.16 -61.25 -61.96 0.07 13 0 "[ . 1 . 2 . 3 . 4 . ]"
8 PSI 1 16 LYS N 1 16 LYS CA 1 16 LYS C 1 17 GLU N -48.40 -28.40 -33.58 -29.41 -29.64 0.13 32 0 "[ . 1 . 2 . 3 . 4 . ]"
9 PHI 1 16 LYS C 1 17 GLU N 1 17 GLU CA 1 17 GLU C -81.30 -50.30 -60.35 -81.26 -51.94 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
10 PSI 1 17 GLU N 1 17 GLU CA 1 17 GLU C 1 18 ILE N -54.60 -26.10 -41.26 -54.73 -26.16 0.13 11 0 "[ . 1 . 2 . 3 . 4 . ]"
11 PHI 1 17 GLU C 1 18 ILE N 1 18 ILE CA 1 18 ILE C -76.00 -56.00 -72.04 -76.61 -60.34 0.61 46 0 "[ . 1 . 2 . 3 . 4 . ]"
12 PSI 1 18 ILE N 1 18 ILE CA 1 18 ILE C 1 19 ASP N -53.00 -29.00 -51.22 -43.61 -45.40 0.45 46 0 "[ . 1 . 2 . 3 . 4 . ]"
13 PHI 1 18 ILE C 1 19 ASP N 1 19 ASP CA 1 19 ASP C -71.40 -49.90 -54.63 -62.15 -50.81 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
14 PSI 1 19 ASP N 1 19 ASP CA 1 19 ASP C 1 20 MET N -52.80 -32.80 -41.50 -53.12 -32.84 0.32 46 0 "[ . 1 . 2 . 3 . 4 . ]"
15 PHI 1 19 ASP C 1 20 MET N 1 20 MET CA 1 20 MET C -76.30 -54.60 -75.08 -76.53 -59.17 0.23 28 0 "[ . 1 . 2 . 3 . 4 . ]"
16 PSI 1 20 MET N 1 20 MET CA 1 20 MET C 1 21 LEU N -52.50 -30.10 -31.37 -43.81 -28.56 1.54 46 0 "[ . 1 . 2 . 3 . 4 . ]"
17 PHI 1 20 MET C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -78.80 -52.60 -61.39 -60.31 -60.59 0.12 23 0 "[ . 1 . 2 . 3 . 4 . ]"
18 PSI 1 21 LEU N 1 21 LEU CA 1 21 LEU C 1 22 LEU N -55.50 -24.30 -54.77 -48.45 -49.92 0.29 22 0 "[ . 1 . 2 . 3 . 4 . ]"
19 PHI 1 21 LEU C 1 22 LEU N 1 22 LEU CA 1 22 LEU C -81.10 -54.30 -59.99 -67.13 -54.01 0.29 46 0 "[ . 1 . 2 . 3 . 4 . ]"
20 PSI 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 LYS N -51.10 -28.50 -46.30 -52.85 -32.96 1.75 46 0 "[ . 1 . 2 . 3 . 4 . ]"
21 PHI 1 22 LEU C 1 23 LYS N 1 23 LYS CA 1 23 LYS C -79.80 -49.90 -60.91 -74.71 -53.60 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
22 PSI 1 23 LYS N 1 23 LYS CA 1 23 LYS C 1 24 GLU N -57.90 -15.40 -49.34 -58.00 -38.04 0.10 26 0 "[ . 1 . 2 . 3 . 4 . ]"
23 PHI 1 23 LYS C 1 24 GLU N 1 24 GLU CA 1 24 GLU C -79.00 -58.00 -58.41 -58.25 -58.33 2.41 46 0 "[ . 1 . 2 . 3 . 4 . ]"
24 PSI 1 24 GLU N 1 24 GLU CA 1 24 GLU C 1 25 TYR N -54.10 -23.90 -44.07 -49.26 -49.42 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
25 PHI 1 24 GLU C 1 25 TYR N 1 25 TYR CA 1 25 TYR C -75.60 -51.70 -65.02 -76.88 -58.98 1.28 23 0 "[ . 1 . 2 . 3 . 4 . ]"
26 PSI 1 25 TYR N 1 25 TYR CA 1 25 TYR C 1 26 LEU N -52.20 -32.20 -43.41 -43.68 -44.30 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
27 PHI 1 25 TYR C 1 26 LEU N 1 26 LEU CA 1 26 LEU C -82.00 -50.90 -64.29 -74.08 -58.65 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
28 PSI 1 26 LEU N 1 26 LEU CA 1 26 LEU C 1 27 LEU N -58.30 -17.80 -22.30 -22.32 -22.45 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
29 PHI 1 26 LEU C 1 27 LEU N 1 27 LEU CA 1 27 LEU C -87.00 -59.00 -85.29 -86.91 -86.97 1.87 23 0 "[ . 1 . 2 . 3 . 4 . ]"
30 PSI 1 27 LEU N 1 27 LEU CA 1 27 LEU C 1 28 SER N -53.00 -5.00 -52.46 -53.25 -40.23 0.25 16 0 "[ . 1 . 2 . 3 . 4 . ]"
31 PHI 1 30 ASP C 1 31 ILE N 1 31 ILE CA 1 31 ILE C -71.00 -47.00 -59.34 -66.07 -67.46 0.06 46 0 "[ . 1 . 2 . 3 . 4 . ]"
32 PSI 1 31 ILE N 1 31 ILE CA 1 31 ILE C 1 32 SER N -64.00 -20.00 -30.31 -48.06 -23.37 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
33 PHI 1 31 ILE C 1 32 SER N 1 32 SER CA 1 32 SER C -76.00 -48.00 -60.82 -62.68 -63.46 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
34 PSI 1 32 SER N 1 32 SER CA 1 32 SER C 1 33 GLU N -54.00 -26.00 -40.57 -48.76 -31.58 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
35 PHI 1 32 SER C 1 33 GLU N 1 33 GLU CA 1 33 GLU C -73.00 -53.00 -72.66 -73.35 -69.27 0.35 46 0 "[ . 1 . 2 . 3 . 4 . ]"
36 PSI 1 33 GLU N 1 33 GLU CA 1 33 GLU C 1 34 ALA N -63.00 -23.00 -39.63 -34.27 -34.69 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
37 PHI 1 33 GLU C 1 34 ALA N 1 34 ALA CA 1 34 ALA C -77.00 -51.80 -64.44 -66.52 -66.57 0.07 14 0 "[ . 1 . 2 . 3 . 4 . ]"
38 PSI 1 34 ALA N 1 34 ALA CA 1 34 ALA C 1 35 GLU N -54.70 -24.80 -53.69 -55.11 -45.22 0.41 11 0 "[ . 1 . 2 . 3 . 4 . ]"
39 PHI 1 34 ALA C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -74.60 -54.60 -57.25 -69.23 -53.95 0.65 22 0 "[ . 1 . 2 . 3 . 4 . ]"
40 PSI 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 HIS N -50.20 -30.20 -30.72 -31.47 -31.59 0.51 46 0 "[ . 1 . 2 . 3 . 4 . ]"
41 PHI 1 35 GLU C 1 36 HIS N 1 36 HIS CA 1 36 HIS C -72.70 -52.70 -59.45 -67.76 -52.84 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
42 PSI 1 36 HIS N 1 36 HIS CA 1 36 HIS C 1 37 CYS N -56.30 -32.00 -37.60 -39.77 -40.82 0.24 26 0 "[ . 1 . 2 . 3 . 4 . ]"
43 PHI 1 36 HIS C 1 37 CYS N 1 37 CYS CA 1 37 CYS C -71.80 -51.80 -63.00 -71.76 -51.63 0.17 23 0 "[ . 1 . 2 . 3 . 4 . ]"
44 PSI 1 37 CYS N 1 37 CYS CA 1 37 CYS C 1 38 LEU N -54.50 -34.50 -51.86 -56.10 -35.73 1.60 24 0 "[ . 1 . 2 . 3 . 4 . ]"
45 PHI 1 37 CYS C 1 38 LEU N 1 38 LEU CA 1 38 LEU C -73.80 -53.80 -63.15 -72.96 -73.63 0.62 5 0 "[ . 1 . 2 . 3 . 4 . ]"
46 PSI 1 38 LEU N 1 38 LEU CA 1 38 LEU C 1 39 LYS N -54.30 -28.60 -30.89 -42.74 -26.22 2.38 24 0 "[ . 1 . 2 . 3 . 4 . ]"
47 PHI 1 38 LEU C 1 39 LYS N 1 39 LYS CA 1 39 LYS C -76.60 -48.10 -70.00 -66.86 -66.99 0.43 36 0 "[ . 1 . 2 . 3 . 4 . ]"
48 PSI 1 39 LYS N 1 39 LYS CA 1 39 LYS C 1 40 GLU N -51.40 -26.10 -35.86 -30.32 -33.36 0.66 24 0 "[ . 1 . 2 . 3 . 4 . ]"
49 PHI 1 39 LYS C 1 40 GLU N 1 40 GLU CA 1 40 GLU C -82.00 -50.00 -62.38 -77.95 -51.00 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
50 PSI 1 40 GLU N 1 40 GLU CA 1 40 GLU C 1 41 LEU N -58.00 -14.00 -39.21 -38.15 -40.13 0.20 44 0 "[ . 1 . 2 . 3 . 4 . ]"
51 PHI 1 47 HIS C 1 48 HIS N 1 48 HIS CA 1 48 HIS C -77.00 -49.00 -64.46 -52.47 -52.91 1.01 41 0 "[ . 1 . 2 . 3 . 4 . ]"
52 PSI 1 48 HIS N 1 48 HIS CA 1 48 HIS C 1 49 GLU N -51.00 -31.00 -33.86 -31.00 -31.07 0.68 22 0 "[ . 1 . 2 . 3 . 4 . ]"
53 PHI 1 48 HIS C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -74.90 -54.90 -64.85 -76.30 -54.03 1.40 16 0 "[ . 1 . 2 . 3 . 4 . ]"
54 PSI 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 LEU N -56.70 -19.90 -34.94 -49.68 -19.77 0.13 22 0 "[ . 1 . 2 . 3 . 4 . ]"
55 PHI 1 49 GLU C 1 50 LEU N 1 50 LEU CA 1 50 LEU C -76.80 -56.80 -58.94 -69.90 -56.12 0.68 32 0 "[ . 1 . 2 . 3 . 4 . ]"
56 PSI 1 50 LEU N 1 50 LEU CA 1 50 LEU C 1 51 VAL N -52.40 -22.90 -50.96 -53.58 -44.78 1.18 22 0 "[ . 1 . 2 . 3 . 4 . ]"
57 PHI 1 50 LEU C 1 51 VAL N 1 51 VAL CA 1 51 VAL C -74.10 -53.30 -56.79 -65.09 -53.01 0.29 32 0 "[ . 1 . 2 . 3 . 4 . ]"
58 PSI 1 51 VAL N 1 51 VAL CA 1 51 VAL C 1 52 TYR N -55.80 -35.80 -50.51 -44.26 -46.28 0.55 22 0 "[ . 1 . 2 . 3 . 4 . ]"
59 PHI 1 51 VAL C 1 52 TYR N 1 52 TYR CA 1 52 TYR C -76.60 -48.00 -55.96 -66.32 -50.69 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
60 PSI 1 52 TYR N 1 52 TYR CA 1 52 TYR C 1 53 GLU N -60.60 -27.90 -58.11 -56.64 -57.33 0.71 27 0 "[ . 1 . 2 . 3 . 4 . ]"
61 PHI 1 52 TYR C 1 53 GLU N 1 53 GLU CA 1 53 GLU C -71.10 -51.10 -54.16 -62.79 -51.13 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
62 PSI 1 53 GLU N 1 53 GLU CA 1 53 GLU C 1 54 ALA N -52.20 -29.00 -37.62 -38.80 -39.12 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
63 PHI 1 53 GLU C 1 54 ALA N 1 54 ALA CA 1 54 ALA C -75.10 -55.10 -64.54 -66.89 -61.61 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
64 PSI 1 54 ALA N 1 54 ALA CA 1 54 ALA C 1 55 ILE N -57.70 -22.30 -48.69 -46.29 -46.41 2.53 29 0 "[ . 1 . 2 . 3 . 4 . ]"
65 PHI 1 54 ALA C 1 55 ILE N 1 55 ILE CA 1 55 ILE C -74.20 -54.20 -64.42 -69.44 -60.51 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
66 PSI 1 55 ILE N 1 55 ILE CA 1 55 ILE C 1 56 VAL N -52.60 -32.60 -47.18 -53.77 -30.58 2.02 44 0 "[ . 1 . 2 . 3 . 4 . ]"
67 PHI 1 55 ILE C 1 56 VAL N 1 56 VAL CA 1 56 VAL C -74.50 -54.00 -61.72 -61.40 -61.62 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
68 PSI 1 56 VAL N 1 56 VAL CA 1 56 VAL C 1 57 MET N -54.30 -33.70 -34.66 -32.86 -32.91 1.78 11 0 "[ . 1 . 2 . 3 . 4 . ]"
69 PHI 1 56 VAL C 1 57 MET N 1 57 MET CA 1 57 MET C -71.10 -51.10 -52.44 -51.20 -51.43 0.70 8 0 "[ . 1 . 2 . 3 . 4 . ]"
70 PSI 1 57 MET N 1 57 MET CA 1 57 MET C 1 58 VAL N -53.50 -21.40 -53.87 -56.61 -44.74 3.11 13 0 "[ . 1 . 2 . 3 . 4 . ]"
71 PHI 1 57 MET C 1 58 VAL N 1 58 VAL CA 1 58 VAL C -74.00 -54.00 -74.66 -76.77 -63.86 2.77 21 0 "[ . 1 . 2 . 3 . 4 . ]"
72 PSI 1 58 VAL N 1 58 VAL CA 1 58 VAL C 1 59 LEU N -53.10 -33.10 -35.49 -49.72 -31.25 1.85 47 0 "[ . 1 . 2 . 3 . 4 . ]"
73 PHI 1 58 VAL C 1 59 LEU N 1 59 LEU CA 1 59 LEU C -75.90 -45.20 -51.29 -63.15 -48.01 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
74 PSI 1 59 LEU N 1 59 LEU CA 1 59 LEU C 1 60 GLU N -60.00 -23.30 -42.73 -60.11 -30.63 0.11 47 0 "[ . 1 . 2 . 3 . 4 . ]"
75 PHI 1 59 LEU C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -91.00 -51.00 -83.78 -91.68 -54.84 0.68 42 0 "[ . 1 . 2 . 3 . 4 . ]"
76 PSI 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 SER N -63.00 -11.00 -25.65 -21.83 -22.33 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
77 PHI 1 64 GLU C 1 65 SER N 1 65 SER CA 1 65 SER C -73.00 -49.00 -50.93 -49.53 -49.86 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
78 PSI 1 65 SER N 1 65 SER CA 1 65 SER C 1 66 ALA N -56.00 -16.00 -46.27 -45.14 -45.48 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
79 PHI 1 65 SER C 1 66 ALA N 1 66 ALA CA 1 66 ALA C -84.00 -56.00 -78.73 -80.21 -80.95 0.57 44 0 "[ . 1 . 2 . 3 . 4 . ]"
80 PSI 1 66 ALA N 1 66 ALA CA 1 66 ALA C 1 67 PHE N -53.00 -29.00 -32.60 -41.38 -28.20 0.80 10 0 "[ . 1 . 2 . 3 . 4 . ]"
81 PHI 1 66 ALA C 1 67 PHE N 1 67 PHE CA 1 67 PHE C -74.10 -54.10 -55.33 -65.09 -52.32 1.78 44 0 "[ . 1 . 2 . 3 . 4 . ]"
82 PSI 1 67 PHE N 1 67 PHE CA 1 67 PHE C 1 68 LYS N -50.90 -29.60 -52.78 -54.13 -52.00 3.23 46 0 "[ . 1 . 2 . 3 . 4 . ]"
83 PHI 1 67 PHE C 1 68 LYS N 1 68 LYS CA 1 68 LYS C -75.30 -48.20 -69.52 -69.83 -69.88 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
84 PSI 1 68 LYS N 1 68 LYS CA 1 68 LYS C 1 69 MET N -54.90 -29.50 -32.72 -41.87 -29.02 0.48 45 0 "[ . 1 . 2 . 3 . 4 . ]"
85 PHI 1 68 LYS C 1 69 MET N 1 69 MET CA 1 69 MET C -72.30 -52.30 -64.54 -69.00 -56.33 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
86 PSI 1 69 MET N 1 69 MET CA 1 69 MET C 1 70 ILE N -61.20 -21.20 -52.76 -56.49 -48.81 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
87 PHI 1 69 MET C 1 70 ILE N 1 70 ILE CA 1 70 ILE C -77.30 -54.80 -63.82 -62.65 -62.94 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
88 PSI 1 70 ILE N 1 70 ILE CA 1 70 ILE C 1 71 LEU N -51.90 -26.50 -51.90 -56.15 -46.77 4.25 37 0 "[ . 1 . 2 . 3 . 4 . ]"
89 PHI 1 70 ILE C 1 71 LEU N 1 71 LEU CA 1 71 LEU C -72.00 -51.50 -54.70 -57.75 -51.00 0.50 45 0 "[ . 1 . 2 . 3 . 4 . ]"
90 PSI 1 71 LEU N 1 71 LEU CA 1 71 LEU C 1 72 ASP N -55.70 -32.70 -49.14 -54.81 -38.50 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
91 PHI 1 71 LEU C 1 72 ASP N 1 72 ASP CA 1 72 ASP C -74.40 -54.40 -69.89 -67.92 -68.09 1.76 37 0 "[ . 1 . 2 . 3 . 4 . ]"
92 PSI 1 72 ASP N 1 72 ASP CA 1 72 ASP C 1 73 LEU N -46.60 -26.60 -26.54 -26.47 -26.81 1.49 44 0 "[ . 1 . 2 . 3 . 4 . ]"
93 PHI 1 72 ASP C 1 73 LEU N 1 73 LEU CA 1 73 LEU C -74.10 -54.10 -67.62 -71.10 -61.37 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
94 PSI 1 73 LEU N 1 73 LEU CA 1 73 LEU C 1 74 LEU N -55.00 -35.00 -54.76 -57.42 -46.99 2.42 6 0 "[ . 1 . 2 . 3 . 4 . ]"
95 PHI 1 73 LEU C 1 74 LEU N 1 74 LEU CA 1 74 LEU C -72.20 -52.20 -68.76 -67.60 -68.04 0.76 37 0 "[ . 1 . 2 . 3 . 4 . ]"
96 PSI 1 74 LEU N 1 74 LEU CA 1 74 LEU C 1 75 LYS N -55.60 -30.60 -36.30 -35.30 -35.35 0.15 17 0 "[ . 1 . 2 . 3 . 4 . ]"
97 PHI 1 74 LEU C 1 75 LYS N 1 75 LYS CA 1 75 LYS C -71.30 -51.30 -55.89 -67.27 -50.88 0.42 39 0 "[ . 1 . 2 . 3 . 4 . ]"
98 PSI 1 75 LYS N 1 75 LYS CA 1 75 LYS C 1 76 SER N -50.00 -30.00 -40.66 -44.33 -45.34 0.34 21 0 "[ . 1 . 2 . 3 . 4 . ]"
99 PHI 1 75 LYS C 1 76 SER N 1 76 SER CA 1 76 SER C -72.90 -52.90 -69.99 -64.62 -65.47 0.85 45 0 "[ . 1 . 2 . 3 . 4 . ]"
100 PSI 1 76 SER N 1 76 SER CA 1 76 SER C 1 77 LEU N -56.80 -31.80 -46.46 -39.54 -40.66 0.31 35 0 "[ . 1 . 2 . 3 . 4 . ]"
101 PHI 1 76 SER C 1 77 LEU N 1 77 LEU CA 1 77 LEU C -72.30 -46.50 -60.32 -72.75 -50.17 0.45 3 0 "[ . 1 . 2 . 3 . 4 . ]"
102 PSI 1 77 LEU N 1 77 LEU CA 1 77 LEU C 1 78 TRP N -60.40 -24.50 -33.87 -50.93 -25.33 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
103 PHI 1 77 LEU C 1 78 TRP N 1 78 TRP CA 1 78 TRP C -71.70 -51.00 -69.05 -71.94 -50.81 0.24 28 0 "[ . 1 . 2 . 3 . 4 . ]"
104 PSI 1 78 TRP N 1 78 TRP CA 1 78 TRP C 1 79 LYS N -53.60 -32.10 -39.31 -36.78 -37.59 0.09 18 0 "[ . 1 . 2 . 3 . 4 . ]"
105 PHI 1 78 TRP C 1 79 LYS N 1 79 LYS CA 1 79 LYS C -83.00 -47.00 -80.97 -83.11 -83.14 0.23 42 0 "[ . 1 . 2 . 3 . 4 . ]"
106 PSI 1 79 LYS N 1 79 LYS CA 1 79 LYS C 1 80 SER N -52.00 -4.00 -16.77 -30.79 -6.43 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
107 PHI 1 79 LYS C 1 80 SER N 1 80 SER CA 1 80 SER C -127.00 -55.00 -90.45 -90.45 -90.53 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
108 PSI 1 80 SER N 1 80 SER CA 1 80 SER C 1 81 SER N -17.00 11.00 10.63 3.19 11.51 0.51 6 0 "[ . 1 . 2 . 3 . 4 . ]"
109 PHI 1 84 THR C 1 85 ILE N 1 85 ILE CA 1 85 ILE C -70.00 -50.00 -68.46 -70.75 -62.03 0.75 28 0 "[ . 1 . 2 . 3 . 4 . ]"
110 PSI 1 85 ILE N 1 85 ILE CA 1 85 ILE C 1 86 ASP N -54.00 -22.00 -27.76 -28.37 -28.63 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
111 PHI 1 85 ILE C 1 86 ASP N 1 86 ASP CA 1 86 ASP C -78.00 -54.00 -69.68 -72.62 -73.08 0.26 28 0 "[ . 1 . 2 . 3 . 4 . ]"
112 PSI 1 86 ASP N 1 86 ASP CA 1 86 ASP C 1 87 GLN N -50.00 -26.00 -42.27 -50.59 -25.88 0.59 28 0 "[ . 1 . 2 . 3 . 4 . ]"
113 PHI 1 86 ASP C 1 87 GLN N 1 87 GLN CA 1 87 GLN C -75.70 -55.70 -63.10 -63.86 -65.60 0.31 28 0 "[ . 1 . 2 . 3 . 4 . ]"
114 PSI 1 87 GLN N 1 87 GLN CA 1 87 GLN C 1 88 MET N -57.00 -31.00 -40.84 -46.44 -51.05 0.16 34 0 "[ . 1 . 2 . 3 . 4 . ]"
115 PHI 1 87 GLN C 1 88 MET N 1 88 MET CA 1 88 MET C -73.00 -53.00 -66.43 -73.12 -52.86 0.14 17 0 "[ . 1 . 2 . 3 . 4 . ]"
116 PSI 1 88 MET N 1 88 MET CA 1 88 MET C 1 89 LYS N -52.30 -32.30 -47.24 -47.98 -48.84 0.11 3 0 "[ . 1 . 2 . 3 . 4 . ]"
117 PHI 1 88 MET C 1 89 LYS N 1 89 LYS CA 1 89 LYS C -72.40 -52.40 -55.28 -56.43 -56.59 0.18 35 0 "[ . 1 . 2 . 3 . 4 . ]"
118 PSI 1 89 LYS N 1 89 LYS CA 1 89 LYS C 1 90 ARG N -54.10 -31.60 -43.05 -42.69 -43.34 0.07 46 0 "[ . 1 . 2 . 3 . 4 . ]"
119 PHI 1 89 LYS C 1 90 ARG N 1 90 ARG CA 1 90 ARG C -72.00 -52.00 -68.53 -63.03 -64.73 0.22 18 0 "[ . 1 . 2 . 3 . 4 . ]"
120 PSI 1 90 ARG N 1 90 ARG CA 1 90 ARG C 1 91 GLY N -57.00 -29.00 -40.20 -57.12 -28.94 0.12 47 0 "[ . 1 . 2 . 3 . 4 . ]"
121 PHI 1 90 ARG C 1 91 GLY N 1 91 GLY CA 1 91 GLY C -76.50 -53.70 -64.07 -71.47 -73.48 0.91 14 0 "[ . 1 . 2 . 3 . 4 . ]"
122 PSI 1 91 GLY N 1 91 GLY CA 1 91 GLY C 1 92 TYR N -62.70 -24.50 -44.76 -62.41 -29.14 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
123 PHI 1 91 GLY C 1 92 TYR N 1 92 TYR CA 1 92 TYR C -75.70 -48.80 -67.01 -71.85 -74.07 2.62 10 0 "[ . 1 . 2 . 3 . 4 . ]"
124 PSI 1 92 TYR N 1 92 TYR CA 1 92 TYR C 1 93 GLU N -56.00 -36.00 -41.03 -38.88 -39.49 1.04 10 0 "[ . 1 . 2 . 3 . 4 . ]"
125 PHI 1 92 TYR C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -68.10 -48.10 -54.23 -62.20 -50.88 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
126 PSI 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 ARG N -52.80 -32.80 -36.14 -54.67 -32.34 1.87 10 0 "[ . 1 . 2 . 3 . 4 . ]"
127 PHI 1 93 GLU C 1 94 ARG N 1 94 ARG CA 1 94 ARG C -75.00 -55.00 -62.15 -69.32 -54.89 0.11 40 0 "[ . 1 . 2 . 3 . 4 . ]"
128 PSI 1 94 ARG N 1 94 ARG CA 1 94 ARG C 1 95 ILE N -58.00 -26.00 -35.12 -30.24 -32.00 0.45 21 0 "[ . 1 . 2 . 3 . 4 . ]"
129 PHI 1 94 ARG C 1 95 ILE N 1 95 ILE CA 1 95 ILE C -97.00 -37.00 -63.70 -84.56 -53.74 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
130 PSI 1 95 ILE N 1 95 ILE CA 1 95 ILE C 1 96 TYR N -62.00 10.00 -38.45 -37.08 -37.34 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
131 PHI 1 100 PRO C 1 101 ASP N 1 101 ASP CA 1 101 ASP C -103.00 -39.00 -97.08 -106.62 -106.68 4.57 48 0 "[ . 1 . 2 . 3 . 4 . ]"
132 PSI 1 101 ASP N 1 101 ASP CA 1 101 ASP C 1 102 ILE N -73.00 11.00 -21.13 -31.86 -10.81 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
133 PHI 1 101 ASP C 1 102 ILE N 1 102 ILE CA 1 102 ILE C -100.00 -44.00 -51.19 -58.10 -46.73 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
134 PSI 1 102 ILE N 1 102 ILE CA 1 102 ILE C 1 103 ASN N -59.00 -23.00 -27.40 -29.00 -29.31 0.60 40 0 "[ . 1 . 2 . 3 . 4 . ]"
135 PHI 1 108 HIS C 1 109 SER N 1 109 SER CA 1 109 SER C -72.00 -52.00 -60.93 -63.27 -64.78 1.14 18 0 "[ . 1 . 2 . 3 . 4 . ]"
136 PSI 1 109 SER N 1 109 SER CA 1 109 SER C 1 110 TYR N -54.00 -22.00 -38.64 -38.76 -40.34 0.17 47 0 "[ . 1 . 2 . 3 . 4 . ]"
137 PHI 1 109 SER C 1 110 TYR N 1 110 TYR CA 1 110 TYR C -73.10 -53.10 -58.26 -53.04 -53.07 1.15 29 0 "[ . 1 . 2 . 3 . 4 . ]"
138 PSI 1 110 TYR N 1 110 TYR CA 1 110 TYR C 1 111 SER N -57.00 -35.90 -37.94 -38.11 -40.79 1.45 46 0 "[ . 1 . 2 . 3 . 4 . ]"
139 PHI 1 110 TYR C 1 111 SER N 1 111 SER CA 1 111 SER C -75.20 -55.20 -63.64 -75.98 -54.68 0.78 46 0 "[ . 1 . 2 . 3 . 4 . ]"
140 PSI 1 111 SER N 1 111 SER CA 1 111 SER C 1 112 VAL N -49.00 -25.80 -32.23 -50.25 -25.15 1.25 44 0 "[ . 1 . 2 . 3 . 4 . ]"
141 PHI 1 111 SER C 1 112 VAL N 1 112 VAL CA 1 112 VAL C -79.60 -53.60 -77.30 -81.24 -54.51 1.64 20 0 "[ . 1 . 2 . 3 . 4 . ]"
142 PSI 1 112 VAL N 1 112 VAL CA 1 112 VAL C 1 113 LEU N -52.90 -32.90 -45.84 -50.13 -51.22 1.05 46 0 "[ . 1 . 2 . 3 . 4 . ]"
143 PHI 1 112 VAL C 1 113 LEU N 1 113 LEU CA 1 113 LEU C -71.30 -51.30 -55.29 -51.20 -51.20 0.31 34 0 "[ . 1 . 2 . 3 . 4 . ]"
144 PSI 1 113 LEU N 1 113 LEU CA 1 113 LEU C 1 114 GLU N -51.70 -24.60 -50.75 -43.60 -45.10 0.75 41 0 "[ . 1 . 2 . 3 . 4 . ]"
145 PHI 1 113 LEU C 1 114 GLU N 1 114 GLU CA 1 114 GLU C -75.30 -55.30 -57.60 -64.56 -54.84 0.46 23 0 "[ . 1 . 2 . 3 . 4 . ]"
146 PSI 1 114 GLU N 1 114 GLU CA 1 114 GLU C 1 115 ARG N -49.70 -28.90 -45.26 -50.14 -32.89 0.44 35 0 "[ . 1 . 2 . 3 . 4 . ]"
147 PHI 1 114 GLU C 1 115 ARG N 1 115 ARG CA 1 115 ARG C -75.70 -55.70 -65.50 -64.14 -64.36 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
148 PSI 1 115 ARG N 1 115 ARG CA 1 115 ARG C 1 116 PHE N -51.00 -31.00 -40.45 -48.81 -34.37 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
149 PHI 1 115 ARG C 1 116 PHE N 1 116 PHE CA 1 116 PHE C -74.60 -54.60 -67.14 -74.77 -58.59 0.17 37 0 "[ . 1 . 2 . 3 . 4 . ]"
150 PSI 1 116 PHE N 1 116 PHE CA 1 116 PHE C 1 117 VAL N -54.90 -34.90 -38.97 -43.87 -34.57 0.33 37 0 "[ . 1 . 2 . 3 . 4 . ]"
151 PHI 1 116 PHE C 1 117 VAL N 1 117 VAL CA 1 117 VAL C -72.60 -52.60 -72.13 -73.50 -64.58 0.90 46 0 "[ . 1 . 2 . 3 . 4 . ]"
152 PSI 1 117 VAL N 1 117 VAL CA 1 117 VAL C 1 118 GLU N -56.00 -32.40 -53.55 -56.02 -56.04 0.84 46 0 "[ . 1 . 2 . 3 . 4 . ]"
153 PHI 1 117 VAL C 1 118 GLU N 1 118 GLU CA 1 118 GLU C -76.50 -51.80 -57.19 -52.84 -53.17 0.13 48 0 "[ . 1 . 2 . 3 . 4 . ]"
154 PSI 1 118 GLU N 1 118 GLU CA 1 118 GLU C 1 119 GLU N -56.50 -15.40 -29.78 -32.20 -32.39 0.09 19 0 "[ . 1 . 2 . 3 . 4 . ]"
155 PHI 1 118 GLU C 1 119 GLU N 1 119 GLU CA 1 119 GLU C -83.80 -52.70 -70.69 -83.98 -58.29 0.18 11 0 "[ . 1 . 2 . 3 . 4 . ]"
156 PSI 1 119 GLU N 1 119 GLU CA 1 119 GLU C 1 120 CYS N -56.60 -27.90 -45.97 -56.78 -32.58 0.18 36 0 "[ . 1 . 2 . 3 . 4 . ]"
157 PHI 1 119 GLU C 1 120 CYS N 1 120 CYS CA 1 120 CYS C -73.80 -53.80 -63.54 -67.16 -68.97 0.22 25 0 "[ . 1 . 2 . 3 . 4 . ]"
158 PSI 1 120 CYS N 1 120 CYS CA 1 120 CYS C 1 121 PHE N -50.30 -29.20 -33.61 -31.70 -32.36 0.05 23 0 "[ . 1 . 2 . 3 . 4 . ]"
159 PHI 1 120 CYS C 1 121 PHE N 1 121 PHE CA 1 121 PHE C -75.60 -55.60 -57.18 -56.06 -56.23 0.15 23 0 "[ . 1 . 2 . 3 . 4 . ]"
160 PSI 1 121 PHE N 1 121 PHE CA 1 121 PHE C 1 122 GLN N -52.90 -32.90 -40.98 -52.88 -32.93 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
161 PHI 1 121 PHE C 1 122 GLN N 1 122 GLN CA 1 122 GLN C -82.30 -49.20 -72.32 -82.00 -82.06 0.10 21 0 "[ . 1 . 2 . 3 . 4 . ]"
162 PSI 1 122 GLN N 1 122 GLN CA 1 122 GLN C 1 123 ALA N -50.00 -25.10 -28.84 -26.54 -26.79 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
163 PHI 1 122 GLN C 1 123 ALA N 1 123 ALA CA 1 123 ALA C -125.00 -57.00 -68.39 -63.60 -65.83 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
164 PSI 1 123 ALA N 1 123 ALA CA 1 123 ALA C 1 124 GLY N -29.00 27.00 -28.30 -28.77 -28.82 0.15 9 0 "[ . 1 . 2 . 3 . 4 . ]"
165 PHI 1 127 SER C 1 128 LYS N 1 128 LYS CA 1 128 LYS C -67.00 -47.00 -59.53 -68.17 -50.54 1.17 32 0 "[ . 1 . 2 . 3 . 4 . ]"
166 PSI 1 128 LYS N 1 128 LYS CA 1 128 LYS C 1 129 GLN N -58.00 -22.00 -31.47 -23.08 -24.96 0.21 47 0 "[ . 1 . 2 . 3 . 4 . ]"
167 PHI 1 128 LYS C 1 129 GLN N 1 129 GLN CA 1 129 GLN C -71.60 -49.30 -54.94 -66.90 -50.14 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
168 PSI 1 129 GLN N 1 129 GLN CA 1 129 GLN C 1 130 LEU N -56.70 -20.50 -48.26 -56.71 -30.01 0.01 40 0 "[ . 1 . 2 . 3 . 4 . ]"
169 PHI 1 129 GLN C 1 130 LEU N 1 130 LEU CA 1 130 LEU C -75.20 -55.20 -64.32 -62.09 -62.36 0.24 6 0 "[ . 1 . 2 . 3 . 4 . ]"
170 PSI 1 130 LEU N 1 130 LEU CA 1 130 LEU C 1 131 ARG N -51.80 -27.20 -39.34 -43.65 -44.67 0.15 3 0 "[ . 1 . 2 . 3 . 4 . ]"
171 PHI 1 130 LEU C 1 131 ARG N 1 131 ARG CA 1 131 ARG C -82.50 -51.10 -63.52 -82.43 -52.09 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
172 PSI 1 131 ARG N 1 131 ARG CA 1 131 ARG C 1 132 ASP N -54.70 -16.80 -37.80 -35.45 -36.14 . . 0 "[ . 1 . 2 . 3 . 4 . ]"
173 PHI 1 131 ARG C 1 132 ASP N 1 132 ASP CA 1 132 ASP C -81.00 -49.00 -70.96 -81.06 -54.18 0.06 18 0 "[ . 1 . 2 . 3 . 4 . ]"
174 PSI 1 132 ASP N 1 132 ASP CA 1 132 ASP C 1 133 LEU N -53.00 -25.00 -29.96 -39.99 -24.18 0.82 23 0 "[ . 1 . 2 . 3 . 4 . ]"
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