NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
578098 |
2mar   |
19372 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mar
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 414
_TA_constraint_stats_list.Viol_total 22449.64
_TA_constraint_stats_list.Viol_max 22.70
_TA_constraint_stats_list.Viol_rms 1.40
_TA_constraint_stats_list.Viol_average_all_restraints 0.26
_TA_constraint_stats_list.Viol_average_violations_only 2.71
_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 2 ASP C 1 3 THR N 1 3 THR CA 1 3 THR C -154.40 -49.60 -87.02 -128.86 -138.83 . . 0 "[ . 1 . 2]"
2 PSI 1 3 THR N 1 3 THR CA 1 3 THR C 1 4 PRO N 43.70 177.80 159.29 162.79 160.82 . . 0 "[ . 1 . 2]"
3 PHI 1 8 PRO C 1 9 PHE N 1 9 PHE CA 1 9 PHE C -115.80 -42.30 -53.18 -49.90 -51.25 . . 0 "[ . 1 . 2]"
4 PSI 1 9 PHE N 1 9 PHE CA 1 9 PHE C 1 10 LEU N -49.80 20.60 -38.87 -49.78 -14.78 . . 0 "[ . 1 . 2]"
5 PHI 1 10 LEU C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -133.50 9.10 -38.79 -38.49 -40.32 . . 0 "[ . 1 . 2]"
6 PSI 1 11 ALA N 1 11 ALA CA 1 11 ALA C 1 12 GLY N 63.40 -172.80 108.27 99.12 116.55 . . 0 "[ . 1 . 2]"
7 PHI 1 12 GLY C 1 13 ALA N 1 13 ALA CA 1 13 ALA C -125.20 -48.30 -106.95 -125.23 -71.90 0.03 19 0 "[ . 1 . 2]"
8 PSI 1 13 ALA N 1 13 ALA CA 1 13 ALA C 1 14 PRO N 127.80 158.40 159.04 156.85 161.56 3.16 10 0 "[ . 1 . 2]"
9 PHI 1 14 PRO C 1 15 GLN N 1 15 GLN CA 1 15 GLN C -74.00 -28.70 -53.37 -52.90 -53.31 . . 0 "[ . 1 . 2]"
10 PSI 1 15 GLN N 1 15 GLN CA 1 15 GLN C 1 16 ASP N -65.80 -18.10 -37.39 -41.06 -34.01 . . 0 "[ . 1 . 2]"
11 PHI 1 15 GLN C 1 16 ASP N 1 16 ASP CA 1 16 ASP C -80.70 -52.10 -54.75 -57.92 -52.90 . . 0 "[ . 1 . 2]"
12 PSI 1 16 ASP N 1 16 ASP CA 1 16 ASP C 1 17 VAL N -57.40 -11.90 -39.90 -41.26 -42.01 . . 0 "[ . 1 . 2]"
13 PHI 1 16 ASP C 1 17 VAL N 1 17 VAL CA 1 17 VAL C -83.30 -50.30 -80.40 -83.29 -77.47 . . 0 "[ . 1 . 2]"
14 PSI 1 17 VAL N 1 17 VAL CA 1 17 VAL C 1 18 VAL N -52.80 -32.80 -41.18 -40.37 -41.11 . . 0 "[ . 1 . 2]"
15 PHI 1 17 VAL C 1 18 VAL N 1 18 VAL CA 1 18 VAL C -75.70 -48.60 -55.73 -57.56 -53.36 . . 0 "[ . 1 . 2]"
16 PSI 1 18 VAL N 1 18 VAL CA 1 18 VAL C 1 19 LYS N -60.80 -29.00 -38.87 -40.95 -36.82 . . 0 "[ . 1 . 2]"
17 PHI 1 18 VAL C 1 19 LYS N 1 19 LYS CA 1 19 LYS C -70.80 -50.80 -61.52 -59.91 -60.43 . . 0 "[ . 1 . 2]"
18 PSI 1 19 LYS N 1 19 LYS CA 1 19 LYS C 1 20 ALA N -50.60 -30.60 -50.24 -50.66 -50.67 0.50 3 0 "[ . 1 . 2]"
19 PHI 1 19 LYS C 1 20 ALA N 1 20 ALA CA 1 20 ALA C -74.10 -54.10 -55.92 -60.77 -52.84 1.26 8 0 "[ . 1 . 2]"
20 PSI 1 20 ALA N 1 20 ALA CA 1 20 ALA C 1 21 PHE N -52.00 -31.30 -47.68 -50.40 -45.42 . . 0 "[ . 1 . 2]"
21 PHI 1 20 ALA C 1 21 PHE N 1 21 PHE CA 1 21 PHE C -75.00 -55.00 -52.46 -52.11 -52.82 4.37 12 0 "[ . 1 . 2]"
22 PSI 1 21 PHE N 1 21 PHE CA 1 21 PHE C 1 22 PHE N -53.80 -33.70 -52.34 -51.97 -52.34 0.04 1 0 "[ . 1 . 2]"
23 PHI 1 21 PHE C 1 22 PHE N 1 22 PHE CA 1 22 PHE C -71.50 -51.50 -60.77 -63.19 -63.56 . . 0 "[ . 1 . 2]"
24 PSI 1 22 PHE N 1 22 PHE CA 1 22 PHE C 1 23 GLU N -47.50 -27.50 -46.94 -44.82 -44.93 0.11 20 0 "[ . 1 . 2]"
25 PHI 1 22 PHE C 1 23 GLU N 1 23 GLU CA 1 23 GLU C -76.60 -56.60 -64.63 -70.96 -59.33 . . 0 "[ . 1 . 2]"
26 PSI 1 23 GLU N 1 23 GLU CA 1 23 GLU C 1 24 LEU N -51.80 -31.80 -36.35 -34.86 -36.34 5.38 3 1 "[ + . 1 . 2]"
27 PHI 1 23 GLU C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -74.90 -54.90 -64.87 -66.64 -66.70 . . 0 "[ . 1 . 2]"
28 PSI 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 LEU N -54.50 -33.80 -47.94 -41.05 -43.92 0.13 12 0 "[ . 1 . 2]"
29 PHI 1 24 LEU C 1 25 LEU N 1 25 LEU CA 1 25 LEU C -72.80 -50.90 -63.03 -72.23 -57.22 . . 0 "[ . 1 . 2]"
30 PSI 1 25 LEU N 1 25 LEU CA 1 25 LEU C 1 26 LYS N -58.60 -16.40 -36.88 -35.52 -38.82 . . 0 "[ . 1 . 2]"
31 PHI 1 25 LEU C 1 26 LYS N 1 26 LYS CA 1 26 LYS C -95.90 -44.80 -55.49 -53.62 -53.91 . . 0 "[ . 1 . 2]"
32 PSI 1 26 LYS N 1 26 LYS CA 1 26 LYS C 1 27 LYS N -61.50 -7.10 -33.87 -51.84 -24.52 . . 0 "[ . 1 . 2]"
33 PHI 1 26 LYS C 1 27 LYS N 1 27 LYS CA 1 27 LYS C -76.70 -56.70 -71.41 -70.38 -71.40 . . 0 "[ . 1 . 2]"
34 PSI 1 27 LYS N 1 27 LYS CA 1 27 LYS C 1 28 ASP N -49.30 -12.50 -34.17 -25.26 -29.34 . . 0 "[ . 1 . 2]"
35 PHI 1 27 LYS C 1 28 ASP N 1 28 ASP CA 1 28 ASP C -109.80 -41.90 -105.57 -104.21 -107.04 0.05 20 0 "[ . 1 . 2]"
36 PSI 1 28 ASP N 1 28 ASP CA 1 28 ASP C 1 29 GLU N -61.40 30.10 20.11 14.11 30.48 0.38 10 0 "[ . 1 . 2]"
37 PHI 1 28 ASP C 1 29 GLU N 1 29 GLU CA 1 29 GLU C -82.40 -48.90 -61.30 -66.67 -54.83 . . 0 "[ . 1 . 2]"
38 PSI 1 29 GLU N 1 29 GLU CA 1 29 GLU C 1 30 THR N -47.00 -11.40 -22.51 -22.30 -23.30 . . 0 "[ . 1 . 2]"
39 PHI 1 29 GLU C 1 30 THR N 1 30 THR CA 1 30 THR C -140.70 -59.70 -91.90 -111.28 -72.81 . . 0 "[ . 1 . 2]"
40 PSI 1 30 THR N 1 30 THR CA 1 30 THR C 1 31 LYS N -34.30 28.40 0.33 0.77 -0.32 . . 0 "[ . 1 . 2]"
41 PHI 1 31 LYS C 1 32 THR N 1 32 THR CA 1 32 THR C -178.20 -41.80 -97.22 -138.17 -68.59 . . 0 "[ . 1 . 2]"
42 PSI 1 32 THR N 1 32 THR CA 1 32 THR C 1 33 ASP N 153.30 -179.80 170.79 172.02 171.76 . . 0 "[ . 1 . 2]"
43 PHI 1 34 PRO C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -77.60 -57.60 -64.00 -67.53 -71.44 . . 0 "[ . 1 . 2]"
44 PSI 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 ILE N -54.70 -20.10 -45.21 -51.16 -39.01 . . 0 "[ . 1 . 2]"
45 PHI 1 35 GLU C 1 36 ILE N 1 36 ILE CA 1 36 ILE C -71.00 -51.00 -66.64 -68.44 -69.43 . . 0 "[ . 1 . 2]"
46 PSI 1 36 ILE N 1 36 ILE CA 1 36 ILE C 1 37 GLU N -53.40 -33.40 -52.08 -53.53 -47.40 0.13 16 0 "[ . 1 . 2]"
47 PHI 1 36 ILE C 1 37 GLU N 1 37 GLU CA 1 37 GLU C -74.90 -52.80 -55.52 -57.39 -57.95 5.10 5 1 "[ + 1 . 2]"
48 PSI 1 37 GLU N 1 37 GLU CA 1 37 GLU C 1 38 LYS N -57.30 -25.60 -39.97 -52.05 -35.39 . . 0 "[ . 1 . 2]"
49 PHI 1 37 GLU C 1 38 LYS N 1 38 LYS CA 1 38 LYS C -83.80 -50.70 -58.27 -65.19 -52.04 . . 0 "[ . 1 . 2]"
50 PSI 1 38 LYS N 1 38 LYS CA 1 38 LYS C 1 39 ASP N -65.80 -7.90 -55.36 -60.90 -44.29 . . 0 "[ . 1 . 2]"
51 PHI 1 38 LYS C 1 39 ASP N 1 39 ASP CA 1 39 ASP C -76.60 -56.60 -62.66 -65.80 -59.06 . . 0 "[ . 1 . 2]"
52 PSI 1 39 ASP N 1 39 ASP CA 1 39 ASP C 1 40 LEU N -52.60 -23.10 -39.16 -39.14 -40.06 . . 0 "[ . 1 . 2]"
53 PHI 1 39 ASP C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -75.40 -55.40 -62.13 -66.93 -58.72 . . 0 "[ . 1 . 2]"
54 PSI 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 ASP N -51.10 -31.10 -49.98 -51.15 -47.45 0.05 10 0 "[ . 1 . 2]"
55 PHI 1 40 LEU C 1 41 ASP N 1 41 ASP CA 1 41 ASP C -71.80 -51.30 -59.73 -60.80 -61.61 . . 0 "[ . 1 . 2]"
56 PSI 1 41 ASP N 1 41 ASP CA 1 41 ASP C 1 42 ALA N -58.40 -17.20 -35.42 -41.19 -28.38 . . 0 "[ . 1 . 2]"
57 PHI 1 41 ASP C 1 42 ALA N 1 42 ALA CA 1 42 ALA C -78.30 -47.60 -56.70 -61.34 -54.07 . . 0 "[ . 1 . 2]"
58 PSI 1 42 ALA N 1 42 ALA CA 1 42 ALA C 1 43 TRP N -58.90 -30.10 -50.93 -54.80 -47.56 . . 0 "[ . 1 . 2]"
59 PHI 1 42 ALA C 1 43 TRP N 1 43 TRP CA 1 43 TRP C -73.80 -51.20 -73.45 -73.99 -69.24 0.19 8 0 "[ . 1 . 2]"
60 PSI 1 43 TRP N 1 43 TRP CA 1 43 TRP C 1 44 VAL N -58.00 -31.70 -33.41 -36.99 -29.75 1.95 3 0 "[ . 1 . 2]"
61 PHI 1 43 TRP C 1 44 VAL N 1 44 VAL CA 1 44 VAL C -75.10 -47.70 -58.71 -56.89 -57.60 . . 0 "[ . 1 . 2]"
62 PSI 1 44 VAL N 1 44 VAL CA 1 44 VAL C 1 45 ASP N -54.30 -34.30 -31.67 -33.51 -27.80 6.50 10 1 "[ . + . 2]"
63 PHI 1 44 VAL C 1 45 ASP N 1 45 ASP CA 1 45 ASP C -80.20 -50.80 -58.18 -60.39 -55.95 . . 0 "[ . 1 . 2]"
64 PSI 1 45 ASP N 1 45 ASP CA 1 45 ASP C 1 46 THR N -55.40 -10.30 -17.93 -25.75 -12.42 . . 0 "[ . 1 . 2]"
65 PHI 1 45 ASP C 1 46 THR N 1 46 THR CA 1 46 THR C -115.20 -48.00 -98.82 -91.59 -93.27 . . 0 "[ . 1 . 2]"
66 PSI 1 46 THR N 1 46 THR CA 1 46 THR C 1 47 LEU N -61.10 9.00 -14.97 -24.49 -2.99 . . 0 "[ . 1 . 2]"
67 PHI 1 46 THR C 1 47 LEU N 1 47 LEU CA 1 47 LEU C -121.70 -47.30 -64.63 -64.77 -65.45 . . 0 "[ . 1 . 2]"
68 PSI 1 47 LEU N 1 47 LEU CA 1 47 LEU C 1 48 GLY N -71.40 24.40 -60.98 -61.23 -61.98 . . 0 "[ . 1 . 2]"
69 PHI 1 50 ASP C 1 51 TYR N 1 51 TYR CA 1 51 TYR C -76.70 -42.60 -60.12 -76.21 -50.37 . . 0 "[ . 1 . 2]"
70 PSI 1 51 TYR N 1 51 TYR CA 1 51 TYR C 1 52 LYS N -55.40 -26.20 -23.74 -29.38 -20.93 5.27 14 2 "[- . 1 +. 2]"
71 PHI 1 51 TYR C 1 52 LYS N 1 52 LYS CA 1 52 LYS C -74.40 -50.70 -53.71 -53.58 -53.84 5.86 9 1 "[ . +1 . 2]"
72 PSI 1 52 LYS N 1 52 LYS CA 1 52 LYS C 1 53 ALA N -59.80 -27.60 -35.92 -36.11 -36.38 . . 0 "[ . 1 . 2]"
73 PHI 1 52 LYS C 1 53 ALA N 1 53 ALA CA 1 53 ALA C -77.40 -55.80 -66.72 -69.10 -70.66 . . 0 "[ . 1 . 2]"
74 PSI 1 53 ALA N 1 53 ALA CA 1 53 ALA C 1 54 LYS N -52.60 -31.90 -42.36 -52.49 -33.19 . . 0 "[ . 1 . 2]"
75 PHI 1 53 ALA C 1 54 LYS N 1 54 LYS CA 1 54 LYS C -84.00 -49.90 -58.23 -56.85 -59.19 2.08 17 0 "[ . 1 . 2]"
76 PSI 1 54 LYS N 1 54 LYS CA 1 54 LYS C 1 55 PHE N -46.40 -24.30 -42.78 -46.37 -33.08 . . 0 "[ . 1 . 2]"
77 PHI 1 54 LYS C 1 55 PHE N 1 55 PHE CA 1 55 PHE C -73.60 -53.60 -58.87 -66.72 -54.76 . . 0 "[ . 1 . 2]"
78 PSI 1 55 PHE N 1 55 PHE CA 1 55 PHE C 1 56 GLU N -54.10 -32.30 -50.68 -49.14 -50.28 0.05 3 0 "[ . 1 . 2]"
79 PHI 1 55 PHE C 1 56 GLU N 1 56 GLU CA 1 56 GLU C -77.60 -49.00 -58.97 -58.31 -58.50 . . 0 "[ . 1 . 2]"
80 PSI 1 56 GLU N 1 56 GLU CA 1 56 GLU C 1 57 THR N -66.10 -10.70 -43.31 -47.97 -40.34 . . 0 "[ . 1 . 2]"
81 PHI 1 56 GLU C 1 57 THR N 1 57 THR CA 1 57 THR C -76.50 -55.10 -70.76 -76.39 -59.70 . . 0 "[ . 1 . 2]"
82 PSI 1 57 THR N 1 57 THR CA 1 57 THR C 1 58 PHE N -57.70 -27.00 -38.77 -36.04 -37.06 . . 0 "[ . 1 . 2]"
83 PHI 1 57 THR C 1 58 PHE N 1 58 PHE CA 1 58 PHE C -73.20 -52.60 -61.96 -72.79 -54.36 . . 0 "[ . 1 . 2]"
84 PSI 1 58 PHE N 1 58 PHE CA 1 58 PHE C 1 59 LYS N -55.50 -29.10 -51.59 -55.53 -43.29 0.03 20 0 "[ . 1 . 2]"
85 PHI 1 58 PHE C 1 59 LYS N 1 59 LYS CA 1 59 LYS C -71.30 -51.30 -52.63 -50.30 -52.35 3.42 6 0 "[ . 1 . 2]"
86 PSI 1 59 LYS N 1 59 LYS CA 1 59 LYS C 1 60 LYS N -54.70 -33.10 -46.85 -53.12 -39.79 . . 0 "[ . 1 . 2]"
87 PHI 1 59 LYS C 1 60 LYS N 1 60 LYS CA 1 60 LYS C -74.00 -54.00 -60.40 -65.71 -55.82 . . 0 "[ . 1 . 2]"
88 PSI 1 60 LYS N 1 60 LYS CA 1 60 LYS C 1 61 GLU N -57.20 -23.10 -52.59 -49.46 -52.73 0.02 20 0 "[ . 1 . 2]"
89 PHI 1 60 LYS C 1 61 GLU N 1 61 GLU CA 1 61 GLU C -81.30 -48.60 -55.68 -60.72 -52.18 . . 0 "[ . 1 . 2]"
90 PSI 1 61 GLU N 1 61 GLU CA 1 61 GLU C 1 62 MET N -51.00 -26.20 -47.62 -50.93 -41.64 . . 0 "[ . 1 . 2]"
91 PHI 1 61 GLU C 1 62 MET N 1 62 MET CA 1 62 MET C -78.60 -53.40 -63.26 -73.84 -59.78 . . 0 "[ . 1 . 2]"
92 PSI 1 62 MET N 1 62 MET CA 1 62 MET C 1 63 LYS N -53.40 -28.80 -51.77 -50.02 -51.28 0.10 19 0 "[ . 1 . 2]"
93 PHI 1 62 MET C 1 63 LYS N 1 63 LYS CA 1 63 LYS C -74.90 -54.50 -56.53 -63.82 -52.83 1.67 18 0 "[ . 1 . 2]"
94 PSI 1 63 LYS N 1 63 LYS CA 1 63 LYS C 1 64 ALA N -59.60 -18.40 -35.34 -35.24 -35.55 . . 0 "[ . 1 . 2]"
95 PHI 1 63 LYS C 1 64 ALA N 1 64 ALA CA 1 64 ALA C -77.60 -53.60 -69.93 -74.43 -67.08 . . 0 "[ . 1 . 2]"
96 PSI 1 64 ALA N 1 64 ALA CA 1 64 ALA C 1 65 LYS N -51.60 -23.30 -50.72 -51.96 -46.92 0.36 3 0 "[ . 1 . 2]"
97 PHI 1 64 ALA C 1 65 LYS N 1 65 LYS CA 1 65 LYS C -75.90 -55.90 -58.96 -57.34 -58.48 0.16 5 0 "[ . 1 . 2]"
98 PSI 1 65 LYS N 1 65 LYS CA 1 65 LYS C 1 66 GLU N -53.20 -30.80 -50.40 -53.26 -46.40 0.06 5 0 "[ . 1 . 2]"
99 PHI 1 65 LYS C 1 66 GLU N 1 66 GLU CA 1 66 GLU C -69.90 -49.90 -61.02 -61.59 -62.19 . . 0 "[ . 1 . 2]"
100 PSI 1 66 GLU N 1 66 GLU CA 1 66 GLU C 1 67 ALA N -54.20 -34.20 -50.34 -54.11 -38.27 . . 0 "[ . 1 . 2]"
101 PHI 1 66 GLU C 1 67 ALA N 1 67 ALA CA 1 67 ALA C -81.90 -47.50 -59.41 -62.71 -55.52 . . 0 "[ . 1 . 2]"
102 PSI 1 67 ALA N 1 67 ALA CA 1 67 ALA C 1 68 GLU N -58.20 -27.90 -46.89 -40.13 -43.75 . . 0 "[ . 1 . 2]"
103 PHI 1 67 ALA C 1 68 GLU N 1 68 GLU CA 1 68 GLU C -79.20 -52.80 -64.19 -66.16 -66.72 . . 0 "[ . 1 . 2]"
104 PSI 1 68 GLU N 1 68 GLU CA 1 68 GLU C 1 69 LEU N -55.50 -29.40 -48.44 -53.96 -44.61 . . 0 "[ . 1 . 2]"
105 PHI 1 68 GLU C 1 69 LEU N 1 69 LEU CA 1 69 LEU C -74.30 -54.30 -55.98 -59.13 -53.72 0.58 4 0 "[ . 1 . 2]"
106 PSI 1 69 LEU N 1 69 LEU CA 1 69 LEU C 1 70 ALA N -51.20 -31.20 -50.41 -51.07 -51.13 0.09 20 0 "[ . 1 . 2]"
107 PHI 1 69 LEU C 1 70 ALA N 1 70 ALA CA 1 70 ALA C -80.10 -49.80 -60.14 -59.02 -60.12 . . 0 "[ . 1 . 2]"
108 PSI 1 70 ALA N 1 70 ALA CA 1 70 ALA C 1 71 LYS N -52.60 -24.10 -44.08 -51.35 -40.09 . . 0 "[ . 1 . 2]"
109 PHI 1 70 ALA C 1 71 LYS N 1 71 LYS CA 1 71 LYS C -77.40 -57.40 -57.61 -53.16 -54.77 4.24 2 0 "[ . 1 . 2]"
110 PSI 1 71 LYS N 1 71 LYS CA 1 71 LYS C 1 72 ALA N -50.80 -30.60 -50.58 -50.78 -50.84 0.31 20 0 "[ . 1 . 2]"
111 PHI 1 71 LYS C 1 72 ALA N 1 72 ALA CA 1 72 ALA C -71.50 -51.50 -62.55 -64.29 -65.15 . . 0 "[ . 1 . 2]"
112 PSI 1 72 ALA N 1 72 ALA CA 1 72 ALA C 1 73 HIS N -51.60 -31.00 -48.55 -51.32 -44.87 . . 0 "[ . 1 . 2]"
113 PHI 1 72 ALA C 1 73 HIS N 1 73 HIS CA 1 73 HIS C -99.20 -39.50 -57.53 -55.98 -56.63 . . 0 "[ . 1 . 2]"
114 PSI 1 73 HIS N 1 73 HIS CA 1 73 HIS C 1 74 GLU N -73.90 -0.80 -51.15 -56.29 -41.13 . . 0 "[ . 1 . 2]"
115 PHI 1 73 HIS C 1 74 GLU N 1 74 GLU CA 1 74 GLU C -80.90 -49.90 -54.86 -53.70 -54.38 . . 0 "[ . 1 . 2]"
116 PSI 1 74 GLU N 1 74 GLU CA 1 74 GLU C 1 75 GLU N -51.80 -24.20 -44.83 -51.03 -40.81 . . 0 "[ . 1 . 2]"
117 PHI 1 74 GLU C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -77.80 -57.50 -56.95 -61.41 -54.79 2.71 4 0 "[ . 1 . 2]"
118 PSI 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 ALA N -52.60 -32.60 -51.11 -49.50 -50.10 0.03 18 0 "[ . 1 . 2]"
119 PHI 1 75 GLU C 1 76 ALA N 1 76 ALA CA 1 76 ALA C -73.80 -52.70 -66.54 -68.32 -63.19 . . 0 "[ . 1 . 2]"
120 PSI 1 76 ALA N 1 76 ALA CA 1 76 ALA C 1 77 VAL N -51.00 -29.80 -33.34 -51.04 -29.29 0.51 10 0 "[ . 1 . 2]"
121 PHI 1 76 ALA C 1 77 VAL N 1 77 VAL CA 1 77 VAL C -73.00 -53.00 -71.35 -69.98 -72.20 0.26 20 0 "[ . 1 . 2]"
122 PSI 1 77 VAL N 1 77 VAL CA 1 77 VAL C 1 78 ALA N -53.30 -32.90 -25.70 -28.56 -22.57 10.33 4 17 "[* *+*****1- ********]"
123 PHI 1 77 VAL C 1 78 ALA N 1 78 ALA CA 1 78 ALA C -86.10 -50.70 -55.76 -58.04 -58.63 . . 0 "[ . 1 . 2]"
124 PSI 1 78 ALA N 1 78 ALA CA 1 78 ALA C 1 79 LYS N -45.10 -9.70 -30.25 -22.04 -28.57 . . 0 "[ . 1 . 2]"
125 PHI 1 78 ALA C 1 79 LYS N 1 79 LYS CA 1 79 LYS C -117.90 -74.40 -92.23 -116.45 -81.93 . . 0 "[ . 1 . 2]"
126 PSI 1 79 LYS N 1 79 LYS CA 1 79 LYS C 1 80 MET N -46.10 16.00 0.11 -0.69 -1.19 . . 0 "[ . 1 . 2]"
127 PHI 1 80 MET C 1 81 THR N 1 81 THR CA 1 81 THR C -129.70 -32.40 -76.66 -129.97 -52.57 0.27 3 0 "[ . 1 . 2]"
128 PSI 1 81 THR N 1 81 THR CA 1 81 THR C 1 82 PRO N 83.00 -149.10 154.24 156.11 155.66 . . 0 "[ . 1 . 2]"
129 PHI 1 82 PRO C 1 83 GLU N 1 83 GLU CA 1 83 GLU C -75.70 -54.20 -62.32 -62.64 -62.85 . . 0 "[ . 1 . 2]"
130 PSI 1 83 GLU N 1 83 GLU CA 1 83 GLU C 1 84 ALA N -48.60 -28.60 -33.57 -37.97 -27.76 0.84 7 0 "[ . 1 . 2]"
131 PHI 1 83 GLU C 1 84 ALA N 1 84 ALA CA 1 84 ALA C -76.30 -53.20 -63.74 -60.40 -62.23 . . 0 "[ . 1 . 2]"
132 PSI 1 84 ALA N 1 84 ALA CA 1 84 ALA C 1 85 LYS N -53.90 -29.20 -43.96 -42.61 -43.59 . . 0 "[ . 1 . 2]"
133 PHI 1 84 ALA C 1 85 LYS N 1 85 LYS CA 1 85 LYS C -77.00 -53.50 -53.98 -56.12 -50.67 2.83 8 0 "[ . 1 . 2]"
134 PSI 1 85 LYS N 1 85 LYS CA 1 85 LYS C 1 86 LYS N -53.40 -29.20 -46.09 -53.31 -41.26 . . 0 "[ . 1 . 2]"
135 PHI 1 85 LYS C 1 86 LYS N 1 86 LYS CA 1 86 LYS C -74.60 -54.60 -59.95 -62.97 -63.92 . . 0 "[ . 1 . 2]"
136 PSI 1 86 LYS N 1 86 LYS CA 1 86 LYS C 1 87 ALA N -54.80 -34.80 -53.42 -55.44 -47.39 0.64 20 0 "[ . 1 . 2]"
137 PHI 1 86 LYS C 1 87 ALA N 1 87 ALA CA 1 87 ALA C -76.80 -56.70 -58.86 -55.63 -55.87 3.24 9 0 "[ . 1 . 2]"
138 PSI 1 87 ALA N 1 87 ALA CA 1 87 ALA C 1 88 ASP N -55.90 -25.00 -50.59 -55.66 -44.71 . . 0 "[ . 1 . 2]"
139 PHI 1 87 ALA C 1 88 ASP N 1 88 ASP CA 1 88 ASP C -73.70 -51.10 -67.30 -73.13 -55.68 . . 0 "[ . 1 . 2]"
140 PSI 1 88 ASP N 1 88 ASP CA 1 88 ASP C 1 89 ALA N -56.30 -31.00 -38.09 -32.94 -34.83 . . 0 "[ . 1 . 2]"
141 PHI 1 88 ASP C 1 89 ALA N 1 89 ALA CA 1 89 ALA C -75.10 -52.10 -62.34 -68.45 -59.35 . . 0 "[ . 1 . 2]"
142 PSI 1 89 ALA N 1 89 ALA CA 1 89 ALA C 1 90 GLU N -51.70 -29.50 -46.13 -46.57 -47.66 . . 0 "[ . 1 . 2]"
143 PHI 1 89 ALA C 1 90 GLU N 1 90 GLU CA 1 90 GLU C -72.70 -52.60 -56.45 -60.01 -51.30 1.30 13 0 "[ . 1 . 2]"
144 PSI 1 90 GLU N 1 90 GLU CA 1 90 GLU C 1 91 LEU N -53.40 -33.40 -47.11 -53.36 -41.02 . . 0 "[ . 1 . 2]"
145 PHI 1 90 GLU C 1 91 LEU N 1 91 LEU CA 1 91 LEU C -76.90 -56.90 -62.82 -58.65 -59.53 . . 0 "[ . 1 . 2]"
146 PSI 1 91 LEU N 1 91 LEU CA 1 91 LEU C 1 92 SER N -46.10 -26.10 -36.95 -34.77 -35.05 . . 0 "[ . 1 . 2]"
147 PHI 1 91 LEU C 1 92 SER N 1 92 SER CA 1 92 SER C -73.70 -53.70 -71.81 -70.18 -70.67 . . 0 "[ . 1 . 2]"
148 PSI 1 92 SER N 1 92 SER CA 1 92 SER C 1 93 LYS N -52.40 -32.40 -42.76 -50.83 -37.63 . . 0 "[ . 1 . 2]"
149 PHI 1 92 SER C 1 93 LYS N 1 93 LYS CA 1 93 LYS C -82.90 -51.90 -69.41 -64.71 -65.55 . . 0 "[ . 1 . 2]"
150 PSI 1 93 LYS N 1 93 LYS CA 1 93 LYS C 1 94 ILE N -58.60 -26.70 -43.68 -41.93 -42.49 . . 0 "[ . 1 . 2]"
151 PHI 1 93 LYS C 1 94 ILE N 1 94 ILE CA 1 94 ILE C -74.90 -50.70 -68.97 -73.05 -63.41 . . 0 "[ . 1 . 2]"
152 PSI 1 94 ILE N 1 94 ILE CA 1 94 ILE C 1 95 ALA N -54.60 -34.10 -31.77 -37.15 -27.71 6.39 8 2 "[ . +-1 . 2]"
153 PHI 1 94 ILE C 1 95 ALA N 1 95 ALA CA 1 95 ALA C -77.00 -46.00 -61.08 -71.15 -54.06 . . 0 "[ . 1 . 2]"
154 PSI 1 95 ALA N 1 95 ALA CA 1 95 ALA C 1 96 GLU N -61.10 -5.50 -27.66 -41.78 -16.66 . . 0 "[ . 1 . 2]"
155 PHI 1 95 ALA C 1 96 GLU N 1 96 GLU CA 1 96 GLU C -118.80 -80.90 -98.77 -116.86 -76.03 4.87 12 0 "[ . 1 . 2]"
156 PSI 1 96 GLU N 1 96 GLU CA 1 96 GLU C 1 97 ASP N -28.30 29.30 -16.57 -5.34 -9.58 . . 0 "[ . 1 . 2]"
157 PHI 1 96 GLU C 1 97 ASP N 1 97 ASP CA 1 97 ASP C -175.50 20.20 -129.54 -164.79 -57.51 . . 0 "[ . 1 . 2]"
158 PSI 1 97 ASP N 1 97 ASP CA 1 97 ASP C 1 98 ASP N 78.10 -145.60 92.11 78.05 147.02 0.05 12 0 "[ . 1 . 2]"
159 PHI 1 97 ASP C 1 98 ASP N 1 98 ASP CA 1 98 ASP C -103.10 -41.50 -73.78 -103.07 -64.00 . . 0 "[ . 1 . 2]"
160 PSI 1 98 ASP N 1 98 ASP CA 1 98 ASP C 1 99 SER N -47.50 8.20 -21.39 -13.98 -22.66 . . 0 "[ . 1 . 2]"
161 PHI 1 98 ASP C 1 99 SER N 1 99 SER CA 1 99 SER C -124.00 -54.90 -82.88 -124.05 -62.44 0.05 4 0 "[ . 1 . 2]"
162 PSI 1 99 SER N 1 99 SER CA 1 99 SER C 1 100 LEU N -91.20 27.30 -9.92 -7.87 -11.60 . . 0 "[ . 1 . 2]"
163 PHI 1 99 SER C 1 100 LEU N 1 100 LEU CA 1 100 LEU C -176.20 -86.20 -84.69 -113.63 -67.83 18.37 15 12 "[- **. ***** +* * *]"
164 PSI 1 100 LEU N 1 100 LEU CA 1 100 LEU C 1 101 ASN N 84.20 -168.70 106.03 84.16 84.13 0.14 12 0 "[ . 1 . 2]"
165 PHI 1 100 LEU C 1 101 ASN N 1 101 ASN CA 1 101 ASN C -98.40 -77.80 -86.16 -96.34 -65.12 12.68 4 3 "[ +. -* . 2]"
166 PSI 1 101 ASN N 1 101 ASN CA 1 101 ASN C 1 102 GLY N 143.70 -163.60 171.65 153.22 -169.81 . . 0 "[ . 1 . 2]"
167 PHI 1 102 GLY C 1 103 ILE N 1 103 ILE CA 1 103 ILE C -77.80 -54.20 -57.99 -61.94 -63.85 1.57 15 0 "[ . 1 . 2]"
168 PSI 1 103 ILE N 1 103 ILE CA 1 103 ILE C 1 104 GLN N -52.10 -29.10 -28.53 -48.17 -23.18 5.92 1 1 "[+ . 1 . 2]"
169 PHI 1 103 ILE C 1 104 GLN N 1 104 GLN CA 1 104 GLN C -71.70 -51.70 -47.77 -44.94 -46.07 10.40 2 6 "[ + *. *1- . ** 2]"
170 PSI 1 104 GLN N 1 104 GLN CA 1 104 GLN C 1 105 LYS N -50.40 -30.40 -37.20 -46.43 -31.50 . . 0 "[ . 1 . 2]"
171 PHI 1 104 GLN C 1 105 LYS N 1 105 LYS CA 1 105 LYS C -74.70 -54.70 -59.65 -63.99 -55.56 . . 0 "[ . 1 . 2]"
172 PSI 1 105 LYS N 1 105 LYS CA 1 105 LYS C 1 106 ALA N -59.40 -11.60 -59.10 -59.20 -59.33 0.69 20 0 "[ . 1 . 2]"
173 PHI 1 105 LYS C 1 106 ALA N 1 106 ALA CA 1 106 ALA C -109.20 -57.80 -64.04 -69.03 -57.09 0.71 4 0 "[ . 1 . 2]"
174 PSI 1 106 ALA N 1 106 ALA CA 1 106 ALA C 1 107 GLN N -38.20 20.90 -35.48 -38.28 -31.54 0.08 4 0 "[ . 1 . 2]"
175 PHI 1 106 ALA C 1 107 GLN N 1 107 GLN CA 1 107 GLN C -146.90 -47.30 -56.38 -54.70 -55.71 . . 0 "[ . 1 . 2]"
176 PSI 1 107 GLN N 1 107 GLN CA 1 107 GLN C 1 108 LYS N -63.50 74.40 -51.51 -54.70 -46.25 . . 0 "[ . 1 . 2]"
177 PHI 1 107 GLN C 1 108 LYS N 1 108 LYS CA 1 108 LYS C -74.50 -45.10 -56.66 -58.17 -59.38 . . 0 "[ . 1 . 2]"
178 PSI 1 108 LYS N 1 108 LYS CA 1 108 LYS C 1 109 ILE N -52.50 -24.30 -49.48 -49.61 -50.35 . . 0 "[ . 1 . 2]"
179 PHI 1 108 LYS C 1 109 ILE N 1 109 ILE CA 1 109 ILE C -75.90 -53.90 -53.07 -58.31 -49.72 4.18 3 0 "[ . 1 . 2]"
180 PSI 1 109 ILE N 1 109 ILE CA 1 109 ILE C 1 110 GLN N -52.10 -32.10 -49.48 -48.75 -49.19 0.12 16 0 "[ . 1 . 2]"
181 PHI 1 109 ILE C 1 110 GLN N 1 110 GLN CA 1 110 GLN C -69.20 -49.20 -64.71 -69.16 -58.73 . . 0 "[ . 1 . 2]"
182 PSI 1 110 GLN N 1 110 GLN CA 1 110 GLN C 1 111 ALA N -54.70 -25.30 -44.02 -45.35 -45.99 . . 0 "[ . 1 . 2]"
183 PHI 1 110 GLN C 1 111 ALA N 1 111 ALA CA 1 111 ALA C -73.80 -53.80 -60.94 -67.64 -57.15 . . 0 "[ . 1 . 2]"
184 PSI 1 111 ALA N 1 111 ALA CA 1 111 ALA C 1 112 ILE N -49.10 -29.10 -43.11 -49.19 -31.99 0.09 20 0 "[ . 1 . 2]"
185 PHI 1 111 ALA C 1 112 ILE N 1 112 ILE CA 1 112 ILE C -96.10 -50.10 -74.12 -69.05 -70.49 . . 0 "[ . 1 . 2]"
186 PSI 1 112 ILE N 1 112 ILE CA 1 112 ILE C 1 113 TYR N -51.80 -31.80 -37.18 -40.12 -41.11 2.24 4 0 "[ . 1 . 2]"
187 PHI 1 112 ILE C 1 113 TYR N 1 113 TYR CA 1 113 TYR C -77.10 -47.70 -60.59 -71.67 -54.46 . . 0 "[ . 1 . 2]"
188 PSI 1 113 TYR N 1 113 TYR CA 1 113 TYR C 1 114 LYS N -57.30 -27.60 -38.60 -32.61 -35.56 . . 0 "[ . 1 . 2]"
189 PHI 1 113 TYR C 1 114 LYS N 1 114 LYS CA 1 114 LYS C -90.80 -40.70 -67.68 -83.97 -57.30 . . 0 "[ . 1 . 2]"
190 PSI 1 114 LYS N 1 114 LYS CA 1 114 LYS C 1 115 THR N -60.30 -4.70 -17.93 -11.72 -14.49 . . 0 "[ . 1 . 2]"
191 PHI 1 114 LYS C 1 115 THR N 1 115 THR CA 1 115 THR C -132.60 -57.50 -108.14 -132.67 -59.46 0.07 3 0 "[ . 1 . 2]"
192 PSI 1 115 THR N 1 115 THR CA 1 115 THR C 1 116 LEU N -57.80 46.40 13.94 22.05 21.09 2.50 18 0 "[ . 1 . 2]"
193 PHI 1 115 THR C 1 116 LEU N 1 116 LEU CA 1 116 LEU C -159.40 -33.10 -70.42 -65.34 -108.04 . . 0 "[ . 1 . 2]"
194 PSI 1 116 LEU N 1 116 LEU CA 1 116 LEU C 1 117 PRO N 53.50 -174.80 134.03 142.87 75.89 . . 0 "[ . 1 . 2]"
195 PHI 1 117 PRO C 1 118 GLN N 1 118 GLN CA 1 118 GLN C -68.70 -31.20 -60.63 -56.50 -58.47 . . 0 "[ . 1 . 2]"
196 PSI 1 118 GLN N 1 118 GLN CA 1 118 GLN C 1 119 SER N -66.40 -22.60 -24.96 -30.46 -20.49 2.11 11 0 "[ . 1 . 2]"
197 PHI 1 118 GLN C 1 119 SER N 1 119 SER CA 1 119 SER C -72.90 -52.90 -62.37 -58.24 -59.40 . . 0 "[ . 1 . 2]"
198 PSI 1 119 SER N 1 119 SER CA 1 119 SER C 1 120 VAL N -51.60 -31.60 -50.73 -50.73 -51.32 0.14 14 0 "[ . 1 . 2]"
199 PHI 1 119 SER C 1 120 VAL N 1 120 VAL CA 1 120 VAL C -77.30 -55.10 -71.98 -62.94 -68.56 2.30 20 0 "[ . 1 . 2]"
200 PSI 1 120 VAL N 1 120 VAL CA 1 120 VAL C 1 121 LYS N -53.90 -33.90 -39.75 -49.19 -37.02 . . 0 "[ . 1 . 2]"
201 PHI 1 120 VAL C 1 121 LYS N 1 121 LYS CA 1 121 LYS C -69.80 -49.80 -58.39 -62.55 -56.47 . . 0 "[ . 1 . 2]"
202 PSI 1 121 LYS N 1 121 LYS CA 1 121 LYS C 1 122 ASP N -61.50 -28.20 -47.74 -46.27 -46.42 . . 0 "[ . 1 . 2]"
203 PHI 1 121 LYS C 1 122 ASP N 1 122 ASP CA 1 122 ASP C -74.10 -53.20 -67.16 -66.68 -67.79 . . 0 "[ . 1 . 2]"
204 PSI 1 122 ASP N 1 122 ASP CA 1 122 ASP C 1 123 GLU N -52.00 -26.90 -42.06 -38.17 -39.30 . . 0 "[ . 1 . 2]"
205 PHI 1 122 ASP C 1 123 GLU N 1 123 GLU CA 1 123 GLU C -74.20 -50.90 -65.85 -70.74 -59.43 . . 0 "[ . 1 . 2]"
206 PSI 1 123 GLU N 1 123 GLU CA 1 123 GLU C 1 124 LEU N -54.50 -34.10 -34.97 -37.43 -31.28 2.82 1 0 "[ . 1 . 2]"
207 PHI 1 123 GLU C 1 124 LEU N 1 124 LEU CA 1 124 LEU C -98.80 -31.20 -88.23 -90.18 -90.86 . . 0 "[ . 1 . 2]"
208 PSI 1 124 LEU N 1 124 LEU CA 1 124 LEU C 1 125 GLU N -69.00 2.10 -21.17 -24.06 -16.95 . . 0 "[ . 1 . 2]"
209 PHI 1 124 LEU C 1 125 GLU N 1 125 GLU CA 1 125 GLU C -76.80 -54.00 -54.87 -53.08 -53.25 1.84 13 0 "[ . 1 . 2]"
210 PSI 1 125 GLU N 1 125 GLU CA 1 125 GLU C 1 126 LYS N -50.00 -2.50 -28.58 -37.44 -38.22 . . 0 "[ . 1 . 2]"
211 PHI 1 125 GLU C 1 126 LYS N 1 126 LYS CA 1 126 LYS C -98.50 -49.80 -67.67 -72.53 -80.49 . . 0 "[ . 1 . 2]"
212 PSI 1 126 LYS N 1 126 LYS CA 1 126 LYS C 1 127 GLY N -49.20 3.60 -26.20 -43.88 6.48 2.88 16 0 "[ . 1 . 2]"
213 PHI 1 128 ILE C 1 129 GLY N 1 129 GLY CA 1 129 GLY C 37.20 38.40 51.56 46.52 61.10 22.70 19 20 [******************+-]
214 PSI 1 129 GLY N 1 129 GLY CA 1 129 GLY C 1 130 PRO N 74.80 -107.50 75.17 75.10 74.97 0.09 6 0 "[ . 1 . 2]"
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