NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
395285 |
1rqt   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1rqt
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 196
_TA_constraint_stats_list.Viol_count 248
_TA_constraint_stats_list.Viol_total 4473.07
_TA_constraint_stats_list.Viol_max 4.15
_TA_constraint_stats_list.Viol_rms 0.28
_TA_constraint_stats_list.Viol_average_all_restraints 0.06
_TA_constraint_stats_list.Viol_average_violations_only 0.90
_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 CHI1 1 1 SER N 1 1 SER CA 1 1 SER CB 1 1 SER OG 160.00 70.00 -101.04 -172.47 63.60 . . 0 "[ . 1 . 2]"
2 PSI 1 1 SER N 1 1 SER CA 1 1 SER C 1 2 ILE N 70.00 100.00 71.57 71.70 71.64 0.45 18 0 "[ . 1 . 2]"
3 PHI 1 1 SER C 1 2 ILE N 1 2 ILE CA 1 2 ILE C -130.00 -95.00 -103.10 -102.69 -103.95 . . 0 "[ . 1 . 2]"
4 PSI 1 2 ILE N 1 2 ILE CA 1 2 ILE C 1 3 THR N 50.00 80.00 59.92 57.57 61.75 . . 0 "[ . 1 . 2]"
5 PHI 1 2 ILE C 1 3 THR N 1 3 THR CA 1 3 THR C -110.00 -75.00 -86.11 -80.26 -82.86 0.95 7 0 "[ . 1 . 2]"
6 CHI1 1 3 THR N 1 3 THR CA 1 3 THR CB 1 3 THR OG1 40.00 80.00 53.72 48.03 72.70 . . 0 "[ . 1 . 2]"
7 PSI 1 3 THR N 1 3 THR CA 1 3 THR C 1 4 LYS N 150.00 -170.00 159.56 159.04 158.86 . . 0 "[ . 1 . 2]"
8 PHI 1 3 THR C 1 4 LYS N 1 4 LYS CA 1 4 LYS C -75.00 -45.00 -57.70 -55.60 -55.67 . . 0 "[ . 1 . 2]"
9 CHI1 1 4 LYS N 1 4 LYS CA 1 4 LYS CB 1 4 LYS CG -105.00 -35.00 -87.04 -98.70 -82.10 . . 0 "[ . 1 . 2]"
10 PSI 1 4 LYS N 1 4 LYS CA 1 4 LYS C 1 5 ASP N -60.00 -30.00 -44.39 -43.94 -44.05 . . 0 "[ . 1 . 2]"
11 PHI 1 4 LYS C 1 5 ASP N 1 5 ASP CA 1 5 ASP C -70.00 -45.00 -59.17 -59.42 -59.81 . . 0 "[ . 1 . 2]"
12 CHI1 1 5 ASP N 1 5 ASP CA 1 5 ASP CB 1 5 ASP CG -95.00 -30.00 -79.68 -85.42 -88.39 . . 0 "[ . 1 . 2]"
13 PSI 1 5 ASP N 1 5 ASP CA 1 5 ASP C 1 6 GLN N -70.00 -20.00 -44.03 -47.72 -39.27 . . 0 "[ . 1 . 2]"
14 PHI 1 5 ASP C 1 6 GLN N 1 6 GLN CA 1 6 GLN C -70.00 -45.00 -55.27 -59.58 -49.53 . . 0 "[ . 1 . 2]"
15 CHI1 1 6 GLN N 1 6 GLN CA 1 6 GLN CB 1 6 GLN CG -100.00 100.00 -91.56 -93.19 -95.64 2.18 16 0 "[ . 1 . 2]"
16 PSI 1 6 GLN N 1 6 GLN CA 1 6 GLN C 1 7 ILE N -40.00 -20.00 -28.11 -27.50 -28.29 . . 0 "[ . 1 . 2]"
17 PHI 1 6 GLN C 1 7 ILE N 1 7 ILE CA 1 7 ILE C -85.00 -60.00 -79.01 -83.34 -74.83 . . 0 "[ . 1 . 2]"
18 CHI1 1 7 ILE N 1 7 ILE CA 1 7 ILE CB 1 7 ILE CG1 -85.00 -40.00 -61.73 -72.37 -53.69 . . 0 "[ . 1 . 2]"
19 PSI 1 7 ILE N 1 7 ILE CA 1 7 ILE C 1 8 ILE N -60.00 -30.00 -32.79 -33.02 -33.47 . . 0 "[ . 1 . 2]"
20 PHI 1 7 ILE C 1 8 ILE N 1 8 ILE CA 1 8 ILE C -70.00 -50.00 -59.26 -64.69 -54.51 . . 0 "[ . 1 . 2]"
21 CHI1 1 8 ILE N 1 8 ILE CA 1 8 ILE CB 1 8 ILE CG1 -85.00 -50.00 -57.56 -55.97 -56.75 . . 0 "[ . 1 . 2]"
22 PSI 1 8 ILE N 1 8 ILE CA 1 8 ILE C 1 9 GLU N -50.00 -30.00 -49.00 -51.71 -45.14 1.71 5 0 "[ . 1 . 2]"
23 PHI 1 8 ILE C 1 9 GLU N 1 9 GLU CA 1 9 GLU C -85.00 -60.00 -66.70 -64.37 -64.79 . . 0 "[ . 1 . 2]"
24 CHI1 1 9 GLU N 1 9 GLU CA 1 9 GLU CB 1 9 GLU CG -100.00 100.00 -54.27 -84.08 76.00 . . 0 "[ . 1 . 2]"
25 PSI 1 9 GLU N 1 9 GLU CA 1 9 GLU C 1 10 ALA N -60.00 -10.00 -16.78 -16.96 -17.32 . . 0 "[ . 1 . 2]"
26 PHI 1 9 GLU C 1 10 ALA N 1 10 ALA CA 1 10 ALA C -75.00 -45.00 -76.52 -79.15 -74.89 4.15 17 0 "[ . 1 . 2]"
27 PSI 1 10 ALA N 1 10 ALA CA 1 10 ALA C 1 11 VAL N -50.00 -10.00 -39.40 -45.83 -31.12 . . 0 "[ . 1 . 2]"
28 PHI 1 10 ALA C 1 11 VAL N 1 11 VAL CA 1 11 VAL C -85.00 -55.00 -73.58 -83.89 -64.07 . . 0 "[ . 1 . 2]"
29 CHI1 1 11 VAL N 1 11 VAL CA 1 11 VAL CB 1 11 VAL CG1 145.00 -160.00 165.27 162.50 168.53 . . 0 "[ . 1 . 2]"
30 PSI 1 11 VAL N 1 11 VAL CA 1 11 VAL C 1 12 ALA N -30.00 10.00 -24.54 -19.84 -23.23 . . 0 "[ . 1 . 2]"
31 PHI 1 11 VAL C 1 12 ALA N 1 12 ALA CA 1 12 ALA C -120.00 -65.00 -87.66 -93.45 -82.41 . . 0 "[ . 1 . 2]"
32 PSI 1 12 ALA N 1 12 ALA CA 1 12 ALA C 1 13 ALA N -20.00 30.00 5.77 12.02 11.38 . . 0 "[ . 1 . 2]"
33 PHI 1 12 ALA C 1 13 ALA N 1 13 ALA CA 1 13 ALA C -130.00 -95.00 -101.92 -109.41 -94.38 0.62 13 0 "[ . 1 . 2]"
34 PSI 1 13 ALA N 1 13 ALA CA 1 13 ALA C 1 14 MET N -30.00 40.00 -27.25 -29.40 -30.06 0.06 1 0 "[ . 1 . 2]"
35 PHI 1 13 ALA C 1 14 MET N 1 14 MET CA 1 14 MET C -140.00 -85.00 -96.14 -94.42 -95.58 . . 0 "[ . 1 . 2]"
36 CHI1 1 14 MET N 1 14 MET CA 1 14 MET CB 1 14 MET CG -90.00 -30.00 -60.10 -65.95 -55.19 . . 0 "[ . 1 . 2]"
37 PSI 1 14 MET N 1 14 MET CA 1 14 MET C 1 15 SER N 170.00 -170.00 170.37 172.29 171.80 1.72 16 0 "[ . 1 . 2]"
38 PHI 1 14 MET C 1 15 SER N 1 15 SER CA 1 15 SER C -85.00 -55.00 -78.31 -75.57 -76.20 . . 0 "[ . 1 . 2]"
39 CHI1 1 15 SER N 1 15 SER CA 1 15 SER CB 1 15 SER OG 25.00 95.00 24.94 24.58 25.21 0.42 12 0 "[ . 1 . 2]"
40 PSI 1 15 SER N 1 15 SER CA 1 15 SER C 1 16 VAL N 130.00 180.00 163.16 163.39 162.64 . . 0 "[ . 1 . 2]"
41 PHI 1 15 SER C 1 16 VAL N 1 16 VAL CA 1 16 VAL C -75.00 -50.00 -58.67 -65.24 -55.21 . . 0 "[ . 1 . 2]"
42 CHI1 1 16 VAL N 1 16 VAL CA 1 16 VAL CB 1 16 VAL CG1 170.00 -170.00 173.60 175.55 173.90 2.24 6 0 "[ . 1 . 2]"
43 PSI 1 16 VAL N 1 16 VAL CA 1 16 VAL C 1 17 MET N -50.00 -20.00 -44.87 -45.04 -45.36 . . 0 "[ . 1 . 2]"
44 PHI 1 16 VAL C 1 17 MET N 1 17 MET CA 1 17 MET C -75.00 -40.00 -57.30 -61.56 -52.06 . . 0 "[ . 1 . 2]"
45 CHI1 1 17 MET N 1 17 MET CA 1 17 MET CB 1 17 MET CG -95.00 -50.00 -90.29 -91.24 -91.47 . . 0 "[ . 1 . 2]"
46 PSI 1 17 MET N 1 17 MET CA 1 17 MET C 1 18 ASP N -70.00 -35.00 -46.28 -48.93 -45.04 . . 0 "[ . 1 . 2]"
47 PHI 1 17 MET C 1 18 ASP N 1 18 ASP CA 1 18 ASP C -80.00 -55.00 -60.58 -59.29 -60.39 . . 0 "[ . 1 . 2]"
48 CHI1 1 18 ASP N 1 18 ASP CA 1 18 ASP CB 1 18 ASP CG 155.00 -145.00 -168.21 -156.03 -168.67 0.37 13 0 "[ . 1 . 2]"
49 PSI 1 18 ASP N 1 18 ASP CA 1 18 ASP C 1 19 VAL N -60.00 -20.00 -30.62 -37.16 -25.76 . . 0 "[ . 1 . 2]"
50 PHI 1 18 ASP C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -90.00 -45.00 -79.26 -81.45 -82.71 . . 0 "[ . 1 . 2]"
51 CHI1 1 19 VAL N 1 19 VAL CA 1 19 VAL CB 1 19 VAL CG1 145.00 -170.00 172.39 162.24 -177.47 . . 0 "[ . 1 . 2]"
52 PSI 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 VAL N -60.00 -20.00 -32.97 -44.08 -27.93 . . 0 "[ . 1 . 2]"
53 PHI 1 19 VAL C 1 20 VAL N 1 20 VAL CA 1 20 VAL C -80.00 -55.00 -63.41 -62.67 -64.04 . . 0 "[ . 1 . 2]"
54 CHI1 1 20 VAL N 1 20 VAL CA 1 20 VAL CB 1 20 VAL CG1 145.00 -170.00 162.13 155.28 166.29 . . 0 "[ . 1 . 2]"
55 PSI 1 20 VAL N 1 20 VAL CA 1 20 VAL C 1 21 GLU N -60.00 -20.00 -44.59 -55.09 -35.44 . . 0 "[ . 1 . 2]"
56 PHI 1 20 VAL C 1 21 GLU N 1 21 GLU CA 1 21 GLU C -75.00 -55.00 -61.99 -64.21 -66.00 . . 0 "[ . 1 . 2]"
57 CHI1 1 21 GLU N 1 21 GLU CA 1 21 GLU CB 1 21 GLU CG -95.00 -50.00 -80.22 -85.10 -87.00 . . 0 "[ . 1 . 2]"
58 PSI 1 21 GLU N 1 21 GLU CA 1 21 GLU C 1 22 LEU N -80.00 -15.00 -46.67 -45.01 -45.82 . . 0 "[ . 1 . 2]"
59 PHI 1 21 GLU C 1 22 LEU N 1 22 LEU CA 1 22 LEU C -85.00 -55.00 -54.72 -56.58 -53.06 1.94 19 0 "[ . 1 . 2]"
60 CHI1 1 22 LEU N 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 155.00 -155.00 -173.21 -179.44 -165.92 . . 0 "[ . 1 . 2]"
61 PSI 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 ILE N -70.00 0.00 -64.16 -69.12 -57.79 . . 0 "[ . 1 . 2]"
62 PHI 1 22 LEU C 1 23 ILE N 1 23 ILE CA 1 23 ILE C -75.00 -45.00 -49.56 -52.08 -56.57 . . 0 "[ . 1 . 2]"
63 CHI1 1 23 ILE N 1 23 ILE CA 1 23 ILE CB 1 23 ILE CG1 -85.00 -50.00 -72.09 -86.29 -66.71 1.29 14 0 "[ . 1 . 2]"
64 PSI 1 23 ILE N 1 23 ILE CA 1 23 ILE C 1 24 SER N -60.00 -5.00 -42.09 -49.79 -35.99 . . 0 "[ . 1 . 2]"
65 PHI 1 23 ILE C 1 24 SER N 1 24 SER CA 1 24 SER C -85.00 -55.00 -62.79 -71.68 -55.92 . . 0 "[ . 1 . 2]"
66 CHI1 1 24 SER N 1 24 SER CA 1 24 SER CB 1 24 SER OG -100.00 100.00 -87.27 -91.56 -83.72 . . 0 "[ . 1 . 2]"
67 PSI 1 24 SER N 1 24 SER CA 1 24 SER C 1 25 ALA N -80.00 -20.00 -38.97 -41.06 -41.84 . . 0 "[ . 1 . 2]"
68 PHI 1 24 SER C 1 25 ALA N 1 25 ALA CA 1 25 ALA C -85.00 -55.00 -60.40 -58.50 -58.82 . . 0 "[ . 1 . 2]"
69 PSI 1 25 ALA N 1 25 ALA CA 1 25 ALA C 1 26 MET N -70.00 -20.00 -62.14 -69.02 -55.03 . . 0 "[ . 1 . 2]"
70 PHI 1 25 ALA C 1 26 MET N 1 26 MET CA 1 26 MET C -70.00 -45.00 -50.87 -53.44 -54.72 . . 0 "[ . 1 . 2]"
71 CHI1 1 26 MET N 1 26 MET CA 1 26 MET CB 1 26 MET CG -115.00 -50.00 -70.43 -71.87 -67.93 . . 0 "[ . 1 . 2]"
72 PSI 1 26 MET N 1 26 MET CA 1 26 MET C 1 27 GLU N -70.00 -10.00 -41.87 -43.53 -43.59 . . 0 "[ . 1 . 2]"
73 PHI 1 26 MET C 1 27 GLU N 1 27 GLU CA 1 27 GLU C -70.00 -45.00 -50.19 -56.00 -46.77 . . 0 "[ . 1 . 2]"
74 CHI1 1 27 GLU N 1 27 GLU CA 1 27 GLU CB 1 27 GLU CG -95.00 -50.00 -91.49 -95.61 -83.27 0.61 9 0 "[ . 1 . 2]"
75 PSI 1 27 GLU N 1 27 GLU CA 1 27 GLU C 1 28 GLU N -80.00 -45.00 -47.62 -48.23 -48.61 1.24 11 0 "[ . 1 . 2]"
76 PHI 1 27 GLU C 1 28 GLU N 1 28 GLU CA 1 28 GLU C -85.00 -55.00 -78.58 -82.30 -73.37 . . 0 "[ . 1 . 2]"
77 CHI1 1 28 GLU N 1 28 GLU CA 1 28 GLU CB 1 28 GLU CG 155.00 -155.00 -172.65 177.92 176.47 . . 0 "[ . 1 . 2]"
78 PSI 1 28 GLU N 1 28 GLU CA 1 28 GLU C 1 29 LYS N -70.00 -25.00 -47.36 -51.35 -43.60 . . 0 "[ . 1 . 2]"
79 PHI 1 28 GLU C 1 29 LYS N 1 29 LYS CA 1 29 LYS C -65.00 -35.00 -52.53 -49.93 -51.12 . . 0 "[ . 1 . 2]"
80 CHI1 1 29 LYS N 1 29 LYS CA 1 29 LYS CB 1 29 LYS CG 150.00 175.00 176.11 178.02 177.36 3.37 2 0 "[ . 1 . 2]"
81 PSI 1 29 LYS N 1 29 LYS CA 1 29 LYS C 1 30 PHE N -80.00 -30.00 -66.86 -66.73 -67.21 . . 0 "[ . 1 . 2]"
82 PHI 1 29 LYS C 1 30 PHE N 1 30 PHE CA 1 30 PHE C -100.00 -75.00 -74.29 -73.85 -74.11 1.82 18 0 "[ . 1 . 2]"
83 CHI1 1 30 PHE N 1 30 PHE CA 1 30 PHE CB 1 30 PHE CG -95.00 -50.00 -69.49 -78.81 -61.49 . . 0 "[ . 1 . 2]"
84 PSI 1 30 PHE N 1 30 PHE CA 1 30 PHE C 1 31 GLY N -60.00 20.00 -4.10 -11.17 0.07 . . 0 "[ . 1 . 2]"
85 PHI 1 30 PHE C 1 31 GLY N 1 31 GLY CA 1 31 GLY C 30.00 110.00 45.67 50.94 48.94 . . 0 "[ . 1 . 2]"
86 PSI 1 31 GLY N 1 31 GLY CA 1 31 GLY C 1 32 VAL N 10.00 90.00 51.84 57.25 54.77 . . 0 "[ . 1 . 2]"
87 PHI 1 31 GLY C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -165.00 -75.00 -123.30 -135.82 -108.18 . . 0 "[ . 1 . 2]"
88 CHI1 1 32 VAL N 1 32 VAL CA 1 32 VAL CB 1 32 VAL CG1 50.00 -65.00 135.79 56.70 -175.07 . . 0 "[ . 1 . 2]"
89 PSI 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 SER N 25.00 105.00 64.10 73.76 69.95 . . 0 "[ . 1 . 2]"
90 PHI 1 32 VAL C 1 33 SER N 1 33 SER CA 1 33 SER C -165.00 -75.00 -115.00 -149.11 -82.48 . . 0 "[ . 1 . 2]"
91 PSI 1 33 SER N 1 33 SER CA 1 33 SER C 1 34 ALA N 40.00 -170.00 101.44 54.42 157.96 . . 0 "[ . 1 . 2]"
92 PHI 1 33 SER C 1 34 ALA N 1 34 ALA CA 1 34 ALA C 30.00 -80.00 176.84 45.96 -106.97 . . 0 "[ . 1 . 2]"
93 PSI 1 34 ALA N 1 34 ALA CA 1 34 ALA C 1 35 ALA N 30.00 100.00 80.20 82.19 74.42 . . 0 "[ . 1 . 2]"
94 PHI 1 34 ALA C 1 35 ALA N 1 35 ALA CA 1 35 ALA C 40.00 -90.00 -171.84 -164.87 -165.57 . . 0 "[ . 1 . 2]"
95 PSI 1 35 ALA N 1 35 ALA CA 1 35 ALA C 1 36 ALA N 50.00 110.00 81.61 75.44 74.94 . . 0 "[ . 1 . 2]"
96 PHI 1 35 ALA C 1 36 ALA N 1 36 ALA CA 1 36 ALA C -175.00 80.00 -30.47 -44.64 -176.25 1.57 8 0 "[ . 1 . 2]"
97 PSI 1 36 ALA N 1 36 ALA CA 1 36 ALA C 1 37 ALA N 50.00 -170.00 132.03 105.89 63.93 . . 0 "[ . 1 . 2]"
98 PHI 1 36 ALA C 1 37 ALA N 1 37 ALA CA 1 37 ALA C 30.00 -55.00 -158.60 58.92 -60.19 . . 0 "[ . 1 . 2]"
99 CHI1 2 1 SER N 2 1 SER CA 2 1 SER CB 2 1 SER OG 160.00 70.00 -72.89 -89.21 -101.90 . . 0 "[ . 1 . 2]"
100 PSI 2 1 SER N 2 1 SER CA 2 1 SER C 2 2 ILE N 70.00 100.00 73.35 70.87 74.72 . . 0 "[ . 1 . 2]"
101 PHI 2 1 SER C 2 2 ILE N 2 2 ILE CA 2 2 ILE C -130.00 -95.00 -101.11 -106.94 -96.28 . . 0 "[ . 1 . 2]"
102 PSI 2 2 ILE N 2 2 ILE CA 2 2 ILE C 2 3 THR N 50.00 80.00 59.20 57.62 61.01 . . 0 "[ . 1 . 2]"
103 PHI 2 2 ILE C 2 3 THR N 2 3 THR CA 2 3 THR C -110.00 -75.00 -83.57 -85.08 -87.23 0.77 20 0 "[ . 1 . 2]"
104 CHI1 2 3 THR N 2 3 THR CA 2 3 THR CB 2 3 THR OG1 40.00 80.00 53.87 51.64 50.94 . . 0 "[ . 1 . 2]"
105 PSI 2 3 THR N 2 3 THR CA 2 3 THR C 2 4 LYS N 150.00 -170.00 159.19 158.60 158.52 . . 0 "[ . 1 . 2]"
106 PHI 2 3 THR C 2 4 LYS N 2 4 LYS CA 2 4 LYS C -75.00 -45.00 -57.16 -66.49 -52.51 . . 0 "[ . 1 . 2]"
107 CHI1 2 4 LYS N 2 4 LYS CA 2 4 LYS CB 2 4 LYS CG -105.00 -35.00 -87.62 -96.74 -79.67 . . 0 "[ . 1 . 2]"
108 PSI 2 4 LYS N 2 4 LYS CA 2 4 LYS C 2 5 ASP N -60.00 -30.00 -44.40 -43.83 -44.56 . . 0 "[ . 1 . 2]"
109 PHI 2 4 LYS C 2 5 ASP N 2 5 ASP CA 2 5 ASP C -70.00 -45.00 -58.67 -61.58 -56.25 . . 0 "[ . 1 . 2]"
110 CHI1 2 5 ASP N 2 5 ASP CA 2 5 ASP CB 2 5 ASP CG -95.00 -30.00 -77.67 -86.30 -90.76 . . 0 "[ . 1 . 2]"
111 PSI 2 5 ASP N 2 5 ASP CA 2 5 ASP C 2 6 GLN N -70.00 -20.00 -44.53 -41.51 -42.66 . . 0 "[ . 1 . 2]"
112 PHI 2 5 ASP C 2 6 GLN N 2 6 GLN CA 2 6 GLN C -70.00 -45.00 -55.29 -63.12 -50.48 . . 0 "[ . 1 . 2]"
113 CHI1 2 6 GLN N 2 6 GLN CA 2 6 GLN CB 2 6 GLN CG -100.00 100.00 -91.22 -90.01 -90.49 1.90 8 0 "[ . 1 . 2]"
114 PSI 2 6 GLN N 2 6 GLN CA 2 6 GLN C 2 7 ILE N -40.00 -20.00 -27.79 -27.07 -27.33 . . 0 "[ . 1 . 2]"
115 PHI 2 6 GLN C 2 7 ILE N 2 7 ILE CA 2 7 ILE C -85.00 -60.00 -79.72 -79.37 -79.89 . . 0 "[ . 1 . 2]"
116 CHI1 2 7 ILE N 2 7 ILE CA 2 7 ILE CB 2 7 ILE CG1 -85.00 -40.00 -61.53 -55.73 -56.94 . . 0 "[ . 1 . 2]"
117 PSI 2 7 ILE N 2 7 ILE CA 2 7 ILE C 2 8 ILE N -60.00 -30.00 -31.83 -36.14 -28.65 1.35 5 0 "[ . 1 . 2]"
118 PHI 2 7 ILE C 2 8 ILE N 2 8 ILE CA 2 8 ILE C -70.00 -50.00 -59.25 -58.87 -59.30 . . 0 "[ . 1 . 2]"
119 CHI1 2 8 ILE N 2 8 ILE CA 2 8 ILE CB 2 8 ILE CG1 -85.00 -50.00 -56.92 -60.48 -61.87 . . 0 "[ . 1 . 2]"
120 PSI 2 8 ILE N 2 8 ILE CA 2 8 ILE C 2 9 GLU N -50.00 -30.00 -47.28 -50.99 -41.25 0.99 13 0 "[ . 1 . 2]"
121 PHI 2 8 ILE C 2 9 GLU N 2 9 GLU CA 2 9 GLU C -85.00 -60.00 -70.51 -76.36 -63.05 . . 0 "[ . 1 . 2]"
122 CHI1 2 9 GLU N 2 9 GLU CA 2 9 GLU CB 2 9 GLU CG -100.00 100.00 -44.76 -77.66 71.83 . . 0 "[ . 1 . 2]"
123 PSI 2 9 GLU N 2 9 GLU CA 2 9 GLU C 2 10 ALA N -60.00 -10.00 -16.15 -15.84 -16.40 . . 0 "[ . 1 . 2]"
124 PHI 2 9 GLU C 2 10 ALA N 2 10 ALA CA 2 10 ALA C -75.00 -45.00 -76.36 -77.55 -74.54 2.55 5 0 "[ . 1 . 2]"
125 PSI 2 10 ALA N 2 10 ALA CA 2 10 ALA C 2 11 VAL N -50.00 -10.00 -40.50 -46.72 -33.55 . . 0 "[ . 1 . 2]"
126 PHI 2 10 ALA C 2 11 VAL N 2 11 VAL CA 2 11 VAL C -85.00 -55.00 -73.49 -74.34 -75.79 . . 0 "[ . 1 . 2]"
127 CHI1 2 11 VAL N 2 11 VAL CA 2 11 VAL CB 2 11 VAL CG1 145.00 -160.00 164.79 160.21 168.00 . . 0 "[ . 1 . 2]"
128 PSI 2 11 VAL N 2 11 VAL CA 2 11 VAL C 2 12 ALA N -30.00 10.00 -22.66 -16.60 -17.21 . . 0 "[ . 1 . 2]"
129 PHI 2 11 VAL C 2 12 ALA N 2 12 ALA CA 2 12 ALA C -120.00 -65.00 -89.79 -96.73 -98.86 . . 0 "[ . 1 . 2]"
130 PSI 2 12 ALA N 2 12 ALA CA 2 12 ALA C 2 13 ALA N -20.00 30.00 4.52 -9.57 15.69 . . 0 "[ . 1 . 2]"
131 PHI 2 12 ALA C 2 13 ALA N 2 13 ALA CA 2 13 ALA C -130.00 -95.00 -101.05 -109.28 -95.42 . . 0 "[ . 1 . 2]"
132 PSI 2 13 ALA N 2 13 ALA CA 2 13 ALA C 2 14 MET N -30.00 40.00 -26.27 -28.89 -22.75 . . 0 "[ . 1 . 2]"
133 PHI 2 13 ALA C 2 14 MET N 2 14 MET CA 2 14 MET C -140.00 -85.00 -96.68 -84.61 -90.24 0.39 2 0 "[ . 1 . 2]"
134 CHI1 2 14 MET N 2 14 MET CA 2 14 MET CB 2 14 MET CG -90.00 -30.00 -58.79 -66.32 -54.15 . . 0 "[ . 1 . 2]"
135 PSI 2 14 MET N 2 14 MET CA 2 14 MET C 2 15 SER N 170.00 -170.00 170.32 168.60 174.55 1.40 7 0 "[ . 1 . 2]"
136 PHI 2 14 MET C 2 15 SER N 2 15 SER CA 2 15 SER C -85.00 -55.00 -78.03 -82.94 -72.67 . . 0 "[ . 1 . 2]"
137 CHI1 2 15 SER N 2 15 SER CA 2 15 SER CB 2 15 SER OG 25.00 95.00 24.90 24.47 25.18 0.53 20 0 "[ . 1 . 2]"
138 PSI 2 15 SER N 2 15 SER CA 2 15 SER C 2 16 VAL N 130.00 180.00 161.34 162.19 161.26 . . 0 "[ . 1 . 2]"
139 PHI 2 15 SER C 2 16 VAL N 2 16 VAL CA 2 16 VAL C -75.00 -50.00 -57.56 -62.62 -53.56 . . 0 "[ . 1 . 2]"
140 CHI1 2 16 VAL N 2 16 VAL CA 2 16 VAL CB 2 16 VAL CG1 170.00 -170.00 175.11 169.63 -177.14 0.37 18 0 "[ . 1 . 2]"
141 PSI 2 16 VAL N 2 16 VAL CA 2 16 VAL C 2 17 MET N -50.00 -20.00 -45.39 -46.79 -43.11 . . 0 "[ . 1 . 2]"
142 PHI 2 16 VAL C 2 17 MET N 2 17 MET CA 2 17 MET C -75.00 -40.00 -57.34 -61.07 -52.65 . . 0 "[ . 1 . 2]"
143 CHI1 2 17 MET N 2 17 MET CA 2 17 MET CB 2 17 MET CG -95.00 -50.00 -89.85 -89.22 -89.89 . . 0 "[ . 1 . 2]"
144 PSI 2 17 MET N 2 17 MET CA 2 17 MET C 2 18 ASP N -70.00 -35.00 -46.68 -47.74 -45.43 . . 0 "[ . 1 . 2]"
145 PHI 2 17 MET C 2 18 ASP N 2 18 ASP CA 2 18 ASP C -80.00 -55.00 -60.85 -58.19 -58.57 . . 0 "[ . 1 . 2]"
146 CHI1 2 18 ASP N 2 18 ASP CA 2 18 ASP CB 2 18 ASP CG 155.00 -145.00 -171.33 -174.33 -177.40 . . 0 "[ . 1 . 2]"
147 PSI 2 18 ASP N 2 18 ASP CA 2 18 ASP C 2 19 VAL N -60.00 -20.00 -29.91 -34.88 -24.75 . . 0 "[ . 1 . 2]"
148 PHI 2 18 ASP C 2 19 VAL N 2 19 VAL CA 2 19 VAL C -90.00 -45.00 -79.71 -84.90 -77.01 . . 0 "[ . 1 . 2]"
149 CHI1 2 19 VAL N 2 19 VAL CA 2 19 VAL CB 2 19 VAL CG1 145.00 -170.00 169.79 162.95 177.01 . . 0 "[ . 1 . 2]"
150 PSI 2 19 VAL N 2 19 VAL CA 2 19 VAL C 2 20 VAL N -60.00 -20.00 -32.13 -42.53 -28.70 . . 0 "[ . 1 . 2]"
151 PHI 2 19 VAL C 2 20 VAL N 2 20 VAL CA 2 20 VAL C -80.00 -55.00 -64.72 -55.06 -59.18 . . 0 "[ . 1 . 2]"
152 CHI1 2 20 VAL N 2 20 VAL CA 2 20 VAL CB 2 20 VAL CG1 145.00 -170.00 163.78 157.65 172.52 . . 0 "[ . 1 . 2]"
153 PSI 2 20 VAL N 2 20 VAL CA 2 20 VAL C 2 21 GLU N -60.00 -20.00 -43.92 -45.12 -46.12 . . 0 "[ . 1 . 2]"
154 PHI 2 20 VAL C 2 21 GLU N 2 21 GLU CA 2 21 GLU C -75.00 -55.00 -62.97 -59.80 -60.88 . . 0 "[ . 1 . 2]"
155 CHI1 2 21 GLU N 2 21 GLU CA 2 21 GLU CB 2 21 GLU CG -95.00 -50.00 -79.59 -85.64 -88.52 . . 0 "[ . 1 . 2]"
156 PSI 2 21 GLU N 2 21 GLU CA 2 21 GLU C 2 22 LEU N -80.00 -15.00 -46.78 -51.25 -42.73 . . 0 "[ . 1 . 2]"
157 PHI 2 21 GLU C 2 22 LEU N 2 22 LEU CA 2 22 LEU C -85.00 -55.00 -54.83 -55.30 -55.82 2.24 7 0 "[ . 1 . 2]"
158 CHI1 2 22 LEU N 2 22 LEU CA 2 22 LEU CB 2 22 LEU CG 155.00 -155.00 -172.29 -178.86 -159.09 . . 0 "[ . 1 . 2]"
159 PSI 2 22 LEU N 2 22 LEU CA 2 22 LEU C 2 23 ILE N -70.00 0.00 -63.57 -64.36 -64.63 . . 0 "[ . 1 . 2]"
160 PHI 2 22 LEU C 2 23 ILE N 2 23 ILE CA 2 23 ILE C -75.00 -45.00 -49.41 -56.41 -45.00 0.00 8 0 "[ . 1 . 2]"
161 CHI1 2 23 ILE N 2 23 ILE CA 2 23 ILE CB 2 23 ILE CG1 -85.00 -50.00 -70.13 -64.46 -66.53 . . 0 "[ . 1 . 2]"
162 PSI 2 23 ILE N 2 23 ILE CA 2 23 ILE C 2 24 SER N -60.00 -5.00 -44.34 -53.72 -34.86 . . 0 "[ . 1 . 2]"
163 PHI 2 23 ILE C 2 24 SER N 2 24 SER CA 2 24 SER C -85.00 -55.00 -60.89 -59.73 -62.42 0.06 11 0 "[ . 1 . 2]"
164 CHI1 2 24 SER N 2 24 SER CA 2 24 SER CB 2 24 SER OG -100.00 100.00 -87.80 -90.12 -92.66 . . 0 "[ . 1 . 2]"
165 PSI 2 24 SER N 2 24 SER CA 2 24 SER C 2 25 ALA N -80.00 -20.00 -38.88 -42.48 -36.53 . . 0 "[ . 1 . 2]"
166 PHI 2 24 SER C 2 25 ALA N 2 25 ALA CA 2 25 ALA C -85.00 -55.00 -59.39 -61.71 -57.09 . . 0 "[ . 1 . 2]"
167 PSI 2 25 ALA N 2 25 ALA CA 2 25 ALA C 2 26 MET N -70.00 -20.00 -62.59 -63.09 -65.04 . . 0 "[ . 1 . 2]"
168 PHI 2 25 ALA C 2 26 MET N 2 26 MET CA 2 26 MET C -70.00 -45.00 -51.26 -54.78 -48.53 . . 0 "[ . 1 . 2]"
169 CHI1 2 26 MET N 2 26 MET CA 2 26 MET CB 2 26 MET CG -115.00 -50.00 -70.53 -72.52 -68.31 . . 0 "[ . 1 . 2]"
170 PSI 2 26 MET N 2 26 MET CA 2 26 MET C 2 27 GLU N -70.00 -10.00 -42.67 -47.80 -37.74 . . 0 "[ . 1 . 2]"
171 PHI 2 26 MET C 2 27 GLU N 2 27 GLU CA 2 27 GLU C -70.00 -45.00 -49.83 -53.62 -46.01 . . 0 "[ . 1 . 2]"
172 CHI1 2 27 GLU N 2 27 GLU CA 2 27 GLU CB 2 27 GLU CG -95.00 -50.00 -91.40 -90.58 -91.99 1.09 5 0 "[ . 1 . 2]"
173 PSI 2 27 GLU N 2 27 GLU CA 2 27 GLU C 2 28 GLU N -80.00 -45.00 -45.26 -45.18 -45.30 1.39 5 0 "[ . 1 . 2]"
174 PHI 2 27 GLU C 2 28 GLU N 2 28 GLU CA 2 28 GLU C -85.00 -55.00 -79.66 -82.56 -75.39 . . 0 "[ . 1 . 2]"
175 CHI1 2 28 GLU N 2 28 GLU CA 2 28 GLU CB 2 28 GLU CG 165.00 -50.00 -161.84 -163.68 179.23 . . 0 "[ . 1 . 2]"
176 PSI 2 28 GLU N 2 28 GLU CA 2 28 GLU C 2 29 LYS N -70.00 -25.00 -48.27 -41.82 -45.07 . . 0 "[ . 1 . 2]"
177 PHI 2 28 GLU C 2 29 LYS N 2 29 LYS CA 2 29 LYS C -65.00 -35.00 -52.73 -59.05 -48.55 . . 0 "[ . 1 . 2]"
178 CHI1 2 29 LYS N 2 29 LYS CA 2 29 LYS CB 2 29 LYS CG 150.00 175.00 175.78 176.03 175.93 2.58 12 0 "[ . 1 . 2]"
179 PSI 2 29 LYS N 2 29 LYS CA 2 29 LYS C 2 30 PHE N -80.00 -30.00 -66.32 -66.06 -66.90 . . 0 "[ . 1 . 2]"
180 PHI 2 29 LYS C 2 30 PHE N 2 30 PHE CA 2 30 PHE C -100.00 -75.00 -74.52 -76.28 -73.08 1.92 5 0 "[ . 1 . 2]"
181 CHI1 2 30 PHE N 2 30 PHE CA 2 30 PHE CB 2 30 PHE CG -95.00 -50.00 -69.33 -73.72 -77.26 . . 0 "[ . 1 . 2]"
182 PSI 2 30 PHE N 2 30 PHE CA 2 30 PHE C 2 31 GLY N -60.00 20.00 -5.00 -3.30 -4.33 . . 0 "[ . 1 . 2]"
183 PHI 2 30 PHE C 2 31 GLY N 2 31 GLY CA 2 31 GLY C 30.00 110.00 46.44 46.41 45.85 . . 0 "[ . 1 . 2]"
184 PSI 2 31 GLY N 2 31 GLY CA 2 31 GLY C 2 32 VAL N 10.00 90.00 53.33 51.64 51.01 . . 0 "[ . 1 . 2]"
185 PHI 2 31 GLY C 2 32 VAL N 2 32 VAL CA 2 32 VAL C -165.00 -75.00 -117.02 -139.49 -92.25 . . 0 "[ . 1 . 2]"
186 CHI1 2 32 VAL N 2 32 VAL CA 2 32 VAL CB 2 32 VAL CG1 50.00 -65.00 112.94 59.85 -174.65 . . 0 "[ . 1 . 2]"
187 PSI 2 32 VAL N 2 32 VAL CA 2 32 VAL C 2 33 SER N 25.00 105.00 61.17 52.41 49.81 . . 0 "[ . 1 . 2]"
188 PHI 2 32 VAL C 2 33 SER N 2 33 SER CA 2 33 SER C -165.00 -75.00 -113.93 -154.98 -88.36 . . 0 "[ . 1 . 2]"
189 PSI 2 33 SER N 2 33 SER CA 2 33 SER C 2 34 ALA N 40.00 -170.00 97.16 155.21 130.64 . . 0 "[ . 1 . 2]"
190 PHI 2 33 SER C 2 34 ALA N 2 34 ALA CA 2 34 ALA C 30.00 -80.00 169.92 51.78 -117.65 . . 0 "[ . 1 . 2]"
191 PSI 2 34 ALA N 2 34 ALA CA 2 34 ALA C 2 35 ALA N 30.00 100.00 78.68 84.13 77.57 . . 0 "[ . 1 . 2]"
192 PHI 2 34 ALA C 2 35 ALA N 2 35 ALA CA 2 35 ALA C 40.00 -90.00 170.14 -178.03 59.86 . . 0 "[ . 1 . 2]"
193 PSI 2 35 ALA N 2 35 ALA CA 2 35 ALA C 2 36 ALA N 50.00 110.00 88.83 71.93 109.86 . . 0 "[ . 1 . 2]"
194 PHI 2 35 ALA C 2 36 ALA N 2 36 ALA CA 2 36 ALA C -175.00 80.00 40.30 -41.99 -175.51 2.06 17 0 "[ . 1 . 2]"
195 PSI 2 36 ALA N 2 36 ALA CA 2 36 ALA C 2 37 ALA N 50.00 -170.00 126.96 105.72 89.76 . . 0 "[ . 1 . 2]"
196 PHI 2 36 ALA C 2 37 ALA N 2 37 ALA CA 2 37 ALA C 30.00 -55.00 -104.84 -109.32 -118.69 . . 0 "[ . 1 . 2]"
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