NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
575842 |
4csq   |
19848 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_4csq
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 171
_TA_constraint_stats_list.Viol_count 433
_TA_constraint_stats_list.Viol_total 18836.71
_TA_constraint_stats_list.Viol_max 7.80
_TA_constraint_stats_list.Viol_rms 0.84
_TA_constraint_stats_list.Viol_average_all_restraints 0.23
_TA_constraint_stats_list.Viol_average_violations_only 1.98
_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 8 ARG C 1 9 TYR N 1 9 TYR CA 1 9 TYR C -97.50 -47.30 -87.78 -100.41 -68.63 2.91 2 0 "[ . 1 . 2 ]"
2 PSI 1 9 TYR N 1 9 TYR CA 1 9 TYR C 1 10 LEU N 92.50 -172.80 170.22 149.26 -172.81 . . 0 "[ . 1 . 2 ]"
3 PHI 1 9 TYR C 1 10 LEU N 1 10 LEU CA 1 10 LEU C -82.00 -42.00 -64.98 -62.68 -63.14 . . 0 "[ . 1 . 2 ]"
4 PSI 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 LEU N -57.80 -12.00 -27.17 -32.66 -11.93 0.07 5 0 "[ . 1 . 2 ]"
5 PHI 1 10 LEU C 1 11 LEU N 1 11 LEU CA 1 11 LEU C -79.30 -39.30 -62.59 -59.15 -61.11 . . 0 "[ . 1 . 2 ]"
6 PSI 1 11 LEU N 1 11 LEU CA 1 11 LEU C 1 12 ASP N -62.50 -22.50 -41.35 -49.91 -29.97 . . 0 "[ . 1 . 2 ]"
7 PHI 1 11 LEU C 1 12 ASP N 1 12 ASP CA 1 12 ASP C -81.20 -41.20 -73.50 -82.52 -59.95 1.32 13 0 "[ . 1 . 2 ]"
8 PSI 1 12 ASP N 1 12 ASP CA 1 12 ASP C 1 13 GLU N -61.90 -21.90 -30.42 -41.10 -20.05 1.85 5 0 "[ . 1 . 2 ]"
9 PHI 1 12 ASP C 1 13 GLU N 1 13 GLU CA 1 13 GLU C -88.10 -48.10 -74.69 -74.66 -75.36 0.01 17 0 "[ . 1 . 2 ]"
10 PSI 1 13 GLU N 1 13 GLU CA 1 13 GLU C 1 14 LEU N -61.00 -21.00 -36.69 -54.01 -19.17 1.83 5 0 "[ . 1 . 2 ]"
11 PHI 1 13 GLU C 1 14 LEU N 1 14 LEU CA 1 14 LEU C -86.60 -46.60 -72.86 -79.75 -66.37 . . 0 "[ . 1 . 2 ]"
12 PSI 1 14 LEU N 1 14 LEU CA 1 14 LEU C 1 15 GLU N -62.20 -22.20 -23.38 -42.19 -20.47 1.73 17 0 "[ . 1 . 2 ]"
13 PHI 1 14 LEU C 1 15 GLU N 1 15 GLU CA 1 15 GLU C -85.60 -42.80 -71.06 -61.39 -64.18 . . 0 "[ . 1 . 2 ]"
14 PSI 1 15 GLU N 1 15 GLU CA 1 15 GLU C 1 16 THR N -52.80 -6.00 -29.14 -37.34 -40.11 . . 0 "[ . 1 . 2 ]"
15 PHI 1 15 GLU C 1 16 THR N 1 16 THR CA 1 16 THR C -134.90 -79.60 -110.24 -128.32 -83.89 . . 0 "[ . 1 . 2 ]"
16 PSI 1 16 THR N 1 16 THR CA 1 16 THR C 1 17 ALA N -27.40 26.90 8.91 2.68 -3.74 1.80 19 0 "[ . 1 . 2 ]"
17 PHI 1 17 ALA C 1 18 ASP N 1 18 ASP CA 1 18 ASP C -122.10 -63.20 -97.94 -99.12 -100.37 1.02 6 0 "[ . 1 . 2 ]"
18 PSI 1 18 ASP N 1 18 ASP CA 1 18 ASP C 1 19 MET N -61.20 -16.60 -42.47 -57.67 -22.22 . . 0 "[ . 1 . 2 ]"
19 PHI 1 18 ASP C 1 19 MET N 1 19 MET CA 1 19 MET C 176.30 -82.30 -119.25 -135.49 -97.23 . . 0 "[ . 1 . 2 ]"
20 PSI 1 19 MET N 1 19 MET CA 1 19 MET C 1 20 LEU N 130.30 170.30 140.82 129.34 163.63 0.96 19 0 "[ . 1 . 2 ]"
21 PHI 1 19 MET C 1 20 LEU N 1 20 LEU CA 1 20 LEU C -164.20 -105.40 -126.65 -134.95 -139.04 . . 0 "[ . 1 . 2 ]"
22 PSI 1 20 LEU N 1 20 LEU CA 1 20 LEU C 1 21 GLU N 116.70 168.20 131.27 125.13 123.01 2.16 10 0 "[ . 1 . 2 ]"
23 PHI 1 20 LEU C 1 21 GLU N 1 21 GLU CA 1 21 GLU C -155.70 -99.00 -109.75 -138.43 -95.54 3.46 3 0 "[ . 1 . 2 ]"
24 PSI 1 21 GLU N 1 21 GLU CA 1 21 GLU C 1 22 ILE N 112.10 152.10 148.44 130.34 154.83 2.73 15 0 "[ . 1 . 2 ]"
25 PHI 1 21 GLU C 1 22 ILE N 1 22 ILE CA 1 22 ILE C -154.30 -100.10 -133.36 -146.57 -120.77 . . 0 "[ . 1 . 2 ]"
26 PSI 1 22 ILE N 1 22 ILE CA 1 22 ILE C 1 23 ASP N 98.30 139.60 107.23 111.83 109.92 3.15 18 0 "[ . 1 . 2 ]"
27 PHI 1 22 ILE C 1 23 ASP N 1 23 ASP CA 1 23 ASP C 32.70 72.70 60.05 49.98 65.43 . . 0 "[ . 1 . 2 ]"
28 PSI 1 23 ASP N 1 23 ASP CA 1 23 ASP C 1 24 GLY N 23.80 63.80 34.70 26.44 24.95 2.95 9 0 "[ . 1 . 2 ]"
29 PHI 1 23 ASP C 1 24 GLY N 1 24 GLY CA 1 24 GLY C 59.70 99.70 93.99 100.16 99.80 0.95 10 0 "[ . 1 . 2 ]"
30 PSI 1 24 GLY N 1 24 GLY CA 1 24 GLY C 1 25 LEU N -22.00 21.20 -11.21 -24.74 14.91 2.74 18 0 "[ . 1 . 2 ]"
31 PHI 1 24 GLY C 1 25 LEU N 1 25 LEU CA 1 25 LEU C -132.00 -50.90 -99.90 -132.44 -77.68 0.44 13 0 "[ . 1 . 2 ]"
32 PSI 1 25 LEU N 1 25 LEU CA 1 25 LEU C 1 26 HIS N 108.80 166.60 116.39 105.71 155.97 3.09 13 0 "[ . 1 . 2 ]"
33 PHI 1 25 LEU C 1 26 HIS N 1 26 HIS CA 1 26 HIS C -119.70 -59.80 -79.66 -119.73 -65.96 0.03 18 0 "[ . 1 . 2 ]"
34 PSI 1 26 HIS N 1 26 HIS CA 1 26 HIS C 1 27 ALA N 106.80 151.30 127.97 140.22 134.12 . . 0 "[ . 1 . 2 ]"
35 PHI 1 26 HIS C 1 27 ALA N 1 27 ALA CA 1 27 ALA C -160.40 -52.70 -82.61 -92.94 -97.78 . . 0 "[ . 1 . 2 ]"
36 PSI 1 27 ALA N 1 27 ALA CA 1 27 ALA C 1 28 TRP N 59.80 163.50 133.40 155.06 146.82 . . 0 "[ . 1 . 2 ]"
37 PHI 1 27 ALA C 1 28 TRP N 1 28 TRP CA 1 28 TRP C -122.50 -65.70 -81.95 -97.32 -72.52 . . 0 "[ . 1 . 2 ]"
38 PSI 1 28 TRP N 1 28 TRP CA 1 28 TRP C 1 29 ARG N -56.60 -16.60 -24.82 -33.94 -15.79 0.81 1 0 "[ . 1 . 2 ]"
39 PHI 1 28 TRP C 1 29 ARG N 1 29 ARG CA 1 29 ARG C 164.00 -99.50 -147.94 -159.03 -134.18 . . 0 "[ . 1 . 2 ]"
40 PSI 1 29 ARG N 1 29 ARG CA 1 29 ARG C 1 30 PHE N 136.30 176.30 145.57 134.78 173.27 1.52 15 0 "[ . 1 . 2 ]"
41 PHI 1 29 ARG C 1 30 PHE N 1 30 PHE CA 1 30 PHE C -171.50 -120.40 -138.56 -148.28 -153.93 0.93 19 0 "[ . 1 . 2 ]"
42 PSI 1 30 PHE N 1 30 PHE CA 1 30 PHE C 1 31 GLU N 122.70 -178.30 154.23 149.53 146.78 . . 0 "[ . 1 . 2 ]"
43 PHI 1 30 PHE C 1 31 GLU N 1 31 GLU CA 1 31 GLU C -166.10 -105.50 -124.88 -124.58 -125.63 . . 0 "[ . 1 . 2 ]"
44 PSI 1 31 GLU N 1 31 GLU CA 1 31 GLU C 1 32 LEU N 125.50 172.70 140.95 128.33 151.63 . . 0 "[ . 1 . 2 ]"
45 PHI 1 31 GLU C 1 32 LEU N 1 32 LEU CA 1 32 LEU C -138.90 -84.20 -113.01 -115.93 -117.72 . . 0 "[ . 1 . 2 ]"
46 PSI 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 33 ASN N 120.90 160.90 142.75 147.77 146.72 . . 0 "[ . 1 . 2 ]"
47 PHI 1 32 LEU C 1 33 ASN N 1 33 ASN CA 1 33 ASN C -107.40 -54.10 -81.90 -83.54 -84.33 . . 0 "[ . 1 . 2 ]"
48 PSI 1 33 ASN N 1 33 ASN CA 1 33 ASN C 1 34 GLU N 70.60 144.70 91.66 97.72 94.33 . . 0 "[ . 1 . 2 ]"
49 PHI 1 33 ASN C 1 34 GLU N 1 34 GLU CA 1 34 GLU C -75.30 -35.30 -72.12 -72.58 -73.56 2.50 18 0 "[ . 1 . 2 ]"
50 PSI 1 34 GLU N 1 34 GLU CA 1 34 GLU C 1 35 ASN N -77.40 -6.30 -28.95 -43.46 -17.95 . . 0 "[ . 1 . 2 ]"
51 PHI 1 34 GLU C 1 35 ASN N 1 35 ASN CA 1 35 ASN C -82.20 -42.20 -64.68 -71.82 -55.34 . . 0 "[ . 1 . 2 ]"
52 PSI 1 35 ASN N 1 35 ASN CA 1 35 ASN C 1 36 LEU N -64.10 -24.10 -43.02 -40.73 -42.21 . . 0 "[ . 1 . 2 ]"
53 PHI 1 35 ASN C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -84.40 -44.40 -77.55 -81.70 -72.54 . . 0 "[ . 1 . 2 ]"
54 PSI 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 LEU N -63.50 -23.50 -25.95 -32.03 -23.44 0.06 13 0 "[ . 1 . 2 ]"
55 PHI 1 36 LEU C 1 37 LEU N 1 37 LEU CA 1 37 LEU C -82.90 -42.90 -80.87 -78.92 -80.10 1.17 16 0 "[ . 1 . 2 ]"
56 PSI 1 37 LEU N 1 37 LEU CA 1 37 LEU C 1 38 ASP N -58.40 -18.40 -22.21 -28.62 -17.14 1.26 16 0 "[ . 1 . 2 ]"
57 PHI 1 37 LEU C 1 38 ASP N 1 38 ASP CA 1 38 ASP C -85.10 -45.10 -67.45 -71.40 -62.74 . . 0 "[ . 1 . 2 ]"
58 PSI 1 38 ASP N 1 38 ASP CA 1 38 ASP C 1 39 GLN N -59.10 -19.10 -41.08 -43.90 -46.84 . . 0 "[ . 1 . 2 ]"
59 PHI 1 38 ASP C 1 39 GLN N 1 39 GLN CA 1 39 GLN C -83.90 -43.90 -75.75 -83.75 -69.66 . . 0 "[ . 1 . 2 ]"
60 PSI 1 39 GLN N 1 39 GLN CA 1 39 GLN C 1 40 ALA N -60.80 -20.80 -27.76 -29.41 -30.20 1.28 19 0 "[ . 1 . 2 ]"
61 PHI 1 39 GLN C 1 40 ALA N 1 40 ALA CA 1 40 ALA C -88.90 -48.90 -69.43 -77.77 -65.85 . . 0 "[ . 1 . 2 ]"
62 PSI 1 40 ALA N 1 40 ALA CA 1 40 ALA C 1 41 ASP N -57.30 -17.30 -40.56 -46.11 -48.12 . . 0 "[ . 1 . 2 ]"
63 PHI 1 40 ALA C 1 41 ASP N 1 41 ASP CA 1 41 ASP C -87.00 -47.00 -76.55 -89.59 -70.52 2.59 6 0 "[ . 1 . 2 ]"
64 PSI 1 41 ASP N 1 41 ASP CA 1 41 ASP C 1 42 LEU N -63.10 -23.10 -33.26 -41.52 -26.59 . . 0 "[ . 1 . 2 ]"
65 PHI 1 41 ASP C 1 42 LEU N 1 42 LEU CA 1 42 LEU C -88.30 -48.30 -60.35 -60.13 -60.20 . . 0 "[ . 1 . 2 ]"
66 PSI 1 42 LEU N 1 42 LEU CA 1 42 LEU C 1 43 ALA N -58.70 -18.70 -44.93 -50.51 -29.84 . . 0 "[ . 1 . 2 ]"
67 PHI 1 42 LEU C 1 43 ALA N 1 43 ALA CA 1 43 ALA C -87.10 -47.10 -71.15 -68.39 -69.05 1.04 3 0 "[ . 1 . 2 ]"
68 PSI 1 43 ALA N 1 43 ALA CA 1 43 ALA C 1 44 ALA N -59.30 -19.30 -38.37 -37.95 -38.91 . . 0 "[ . 1 . 2 ]"
69 PHI 1 43 ALA C 1 44 ALA N 1 44 ALA CA 1 44 ALA C -86.90 -46.90 -66.01 -64.86 -65.29 . . 0 "[ . 1 . 2 ]"
70 PSI 1 44 ALA N 1 44 ALA CA 1 44 ALA C 1 45 GLU N -59.90 -19.90 -33.62 -34.00 -35.18 . . 0 "[ . 1 . 2 ]"
71 PHI 1 44 ALA C 1 45 GLU N 1 45 GLU CA 1 45 GLU C -85.30 -45.30 -73.94 -80.12 -65.31 . . 0 "[ . 1 . 2 ]"
72 PSI 1 45 GLU N 1 45 GLU CA 1 45 GLU C 1 46 ALA N -49.50 -1.20 -21.62 -15.71 -18.06 . . 0 "[ . 1 . 2 ]"
73 PHI 1 45 GLU C 1 46 ALA N 1 46 ALA CA 1 46 ALA C -114.60 -74.60 -93.52 -104.80 -83.62 . . 0 "[ . 1 . 2 ]"
74 PSI 1 46 ALA N 1 46 ALA CA 1 46 ALA C 1 47 ASP N -17.30 22.70 7.82 7.65 6.81 . . 0 "[ . 1 . 2 ]"
75 PHI 1 46 ALA C 1 47 ASP N 1 47 ASP CA 1 47 ASP C 39.20 94.50 69.11 61.44 77.86 . . 0 "[ . 1 . 2 ]"
76 PSI 1 47 ASP N 1 47 ASP CA 1 47 ASP C 1 48 GLN N -3.80 65.30 20.83 27.01 25.97 0.79 15 0 "[ . 1 . 2 ]"
77 PHI 1 47 ASP C 1 48 GLN N 1 48 GLN CA 1 48 GLN C -146.50 -65.10 -106.00 -118.43 -78.98 . . 0 "[ . 1 . 2 ]"
78 PSI 1 48 GLN N 1 48 GLN CA 1 48 GLN C 1 49 PRO N 66.30 -170.90 129.64 114.67 150.47 . . 0 "[ . 1 . 2 ]"
79 PSI 1 49 PRO N 1 49 PRO CA 1 49 PRO C 1 50 PHE N 126.70 166.70 126.25 125.62 125.34 3.92 22 0 "[ . 1 . 2 ]"
80 PHI 1 49 PRO C 1 50 PHE N 1 50 PHE CA 1 50 PHE C -169.70 -44.70 -95.06 -96.21 -98.90 . . 0 "[ . 1 . 2 ]"
81 PSI 1 50 PHE N 1 50 PHE CA 1 50 PHE C 1 51 ALA N 104.80 159.90 129.39 136.06 134.80 . . 0 "[ . 1 . 2 ]"
82 PHI 1 50 PHE C 1 51 ALA N 1 51 ALA CA 1 51 ALA C -166.70 -62.40 -136.94 -148.28 -120.56 . . 0 "[ . 1 . 2 ]"
83 PSI 1 51 ALA N 1 51 ALA CA 1 51 ALA C 1 52 SER N 119.90 -172.60 125.27 127.52 124.85 2.01 4 0 "[ . 1 . 2 ]"
84 PHI 1 51 ALA C 1 52 SER N 1 52 SER CA 1 52 SER C -152.60 -34.00 -140.89 -153.78 -127.88 1.18 11 0 "[ . 1 . 2 ]"
85 PSI 1 52 SER N 1 52 SER CA 1 52 SER C 1 53 GLU N 108.50 162.10 142.75 142.79 141.36 . . 0 "[ . 1 . 2 ]"
86 PHI 1 55 TRP C 1 56 VAL N 1 56 VAL CA 1 56 VAL C -172.80 -110.40 -134.96 -140.68 -126.22 . . 0 "[ . 1 . 2 ]"
87 PHI 1 56 VAL C 1 57 LEU N 1 57 LEU CA 1 57 LEU C -167.20 -118.30 -137.55 -138.49 -140.67 . . 0 "[ . 1 . 2 ]"
88 PSI 1 57 LEU N 1 57 LEU CA 1 57 LEU C 1 58 ALA N 112.50 152.50 123.28 121.71 117.81 1.05 10 0 "[ . 1 . 2 ]"
89 PHI 1 57 LEU C 1 58 ALA N 1 58 ALA CA 1 58 ALA C -148.30 -91.60 -122.88 -136.11 -104.40 . . 0 "[ . 1 . 2 ]"
90 PSI 1 58 ALA N 1 58 ALA CA 1 58 ALA C 1 59 VAL N 100.10 158.20 105.41 97.78 112.68 2.32 11 0 "[ . 1 . 2 ]"
91 PHI 1 58 ALA C 1 59 VAL N 1 59 VAL CA 1 59 VAL C -148.30 -104.50 -101.47 -106.45 -99.09 5.41 17 2 "[ -. 1 . + 2 ]"
92 PSI 1 59 VAL N 1 59 VAL CA 1 59 VAL C 1 60 GLU N 105.40 164.40 119.41 106.10 137.06 . . 0 "[ . 1 . 2 ]"
93 PHI 1 59 VAL C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -150.60 -102.60 -111.56 -113.76 -118.76 2.40 20 0 "[ . 1 . 2 ]"
94 PSI 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 SER N 113.40 159.20 129.33 115.77 148.47 . . 0 "[ . 1 . 2 ]"
95 PHI 1 60 GLU C 1 61 SER N 1 61 SER CA 1 61 SER C -178.00 -80.30 -129.50 -145.30 -117.00 . . 0 "[ . 1 . 2 ]"
96 PSI 1 61 SER N 1 61 SER CA 1 61 SER C 1 62 LEU N 116.30 159.10 141.76 119.54 159.42 0.32 21 0 "[ . 1 . 2 ]"
97 PHI 1 61 SER C 1 62 LEU N 1 62 LEU CA 1 62 LEU C -153.40 -61.80 -98.67 -96.62 -101.44 . . 0 "[ . 1 . 2 ]"
98 PSI 1 62 LEU N 1 62 LEU CA 1 62 LEU C 1 63 ASP N 107.80 163.00 109.84 103.52 130.50 4.28 20 0 "[ . 1 . 2 ]"
99 PHI 1 62 LEU C 1 63 ASP N 1 63 ASP CA 1 63 ASP C -140.00 -15.60 -104.56 -123.16 -94.30 . . 0 "[ . 1 . 2 ]"
100 PSI 1 63 ASP N 1 63 ASP CA 1 63 ASP C 1 64 GLY N 97.90 169.10 100.88 93.19 117.95 4.71 13 0 "[ . 1 . 2 ]"
101 PHI 1 65 ARG C 1 66 THR N 1 66 THR CA 1 66 THR C -148.00 -35.20 -97.68 -142.62 -66.72 . . 0 "[ . 1 . 2 ]"
102 PSI 1 66 THR N 1 66 THR CA 1 66 THR C 1 67 ARG N 92.80 172.40 138.78 100.26 173.19 0.79 14 0 "[ . 1 . 2 ]"
103 PHI 1 66 THR C 1 67 ARG N 1 67 ARG CA 1 67 ARG C -123.20 -55.90 -95.48 -125.03 -77.82 1.83 19 0 "[ . 1 . 2 ]"
104 PSI 1 67 ARG N 1 67 ARG CA 1 67 ARG C 1 68 ARG N 100.40 165.00 107.40 97.31 131.82 3.09 3 0 "[ . 1 . 2 ]"
105 PHI 1 67 ARG C 1 68 ARG N 1 68 ARG CA 1 68 ARG C -159.70 -87.80 -111.06 -89.84 -92.96 0.34 2 0 "[ . 1 . 2 ]"
106 PSI 1 68 ARG N 1 68 ARG CA 1 68 ARG C 1 69 GLU N 117.50 157.50 119.54 116.13 115.45 4.77 16 0 "[ . 1 . 2 ]"
107 PHI 1 68 ARG C 1 69 GLU N 1 69 GLU CA 1 69 GLU C -152.40 -94.30 -119.17 -120.06 -122.72 . . 0 "[ . 1 . 2 ]"
108 PSI 1 69 GLU N 1 69 GLU CA 1 69 GLU C 1 70 TRP N 124.70 164.70 133.62 127.86 126.06 2.35 1 0 "[ . 1 . 2 ]"
109 PHI 1 69 GLU C 1 70 TRP N 1 70 TRP CA 1 70 TRP C -169.00 -91.10 -112.13 -124.94 -95.62 . . 0 "[ . 1 . 2 ]"
110 PSI 1 70 TRP N 1 70 TRP CA 1 70 TRP C 1 71 ARG N 126.60 167.40 124.38 124.84 124.25 4.89 19 0 "[ . 1 . 2 ]"
111 PHI 1 70 TRP C 1 71 ARG N 1 71 ARG CA 1 71 ARG C -159.80 -101.90 -110.24 -119.00 -102.05 . . 0 "[ . 1 . 2 ]"
112 PSI 1 71 ARG N 1 71 ARG CA 1 71 ARG C 1 72 PHE N 101.40 163.80 120.75 109.91 133.83 . . 0 "[ . 1 . 2 ]"
113 PHI 1 71 ARG C 1 72 PHE N 1 72 PHE CA 1 72 PHE C -145.90 -105.90 -109.82 -108.79 -110.35 4.40 20 0 "[ . 1 . 2 ]"
114 PSI 1 72 PHE N 1 72 PHE CA 1 72 PHE C 1 73 SER N 116.00 156.00 140.89 141.57 140.64 . . 0 "[ . 1 . 2 ]"
115 PHI 1 72 PHE C 1 73 SER N 1 73 SER CA 1 73 SER C -142.30 -31.60 -76.37 -76.02 -76.31 . . 0 "[ . 1 . 2 ]"
116 PSI 1 73 SER N 1 73 SER CA 1 73 SER C 1 74 TYR N 144.10 -170.00 161.34 160.81 160.27 . . 0 "[ . 1 . 2 ]"
117 PHI 1 73 SER C 1 74 TYR N 1 74 TYR CA 1 74 TYR C -78.30 -38.30 -62.99 -68.06 -56.92 . . 0 "[ . 1 . 2 ]"
118 PSI 1 74 TYR N 1 74 TYR CA 1 74 TYR C 1 75 ASN N -61.70 -21.70 -37.06 -44.73 -28.39 . . 0 "[ . 1 . 2 ]"
119 PHI 1 74 TYR C 1 75 ASN N 1 75 ASN CA 1 75 ASN C -81.40 -41.40 -67.36 -62.25 -63.72 . . 0 "[ . 1 . 2 ]"
120 PSI 1 75 ASN N 1 75 ASN CA 1 75 ASN C 1 76 ALA N -61.00 -21.00 -34.69 -47.69 -18.29 2.71 15 0 "[ . 1 . 2 ]"
121 PHI 1 75 ASN C 1 76 ALA N 1 76 ALA CA 1 76 ALA C -83.30 -43.30 -70.02 -61.75 -63.21 . . 0 "[ . 1 . 2 ]"
122 PSI 1 76 ALA N 1 76 ALA CA 1 76 ALA C 1 77 VAL N -60.60 -20.60 -34.89 -44.12 -24.15 . . 0 "[ . 1 . 2 ]"
123 PHI 1 76 ALA C 1 77 VAL N 1 77 VAL CA 1 77 VAL C -88.50 -48.50 -73.49 -64.85 -66.11 . . 0 "[ . 1 . 2 ]"
124 PSI 1 77 VAL N 1 77 VAL CA 1 77 VAL C 1 78 MET N -60.70 -20.30 -27.25 -28.13 -29.08 1.60 17 0 "[ . 1 . 2 ]"
125 PHI 1 77 VAL C 1 78 MET N 1 78 MET CA 1 78 MET C -85.50 -45.50 -72.55 -79.10 -66.75 . . 0 "[ . 1 . 2 ]"
126 PSI 1 78 MET N 1 78 MET CA 1 78 MET C 1 79 GLU N -54.40 -2.60 -37.70 -51.67 -25.87 . . 0 "[ . 1 . 2 ]"
127 PHI 1 78 MET C 1 79 GLU N 1 79 GLU CA 1 79 GLU C -119.60 -77.50 -89.29 -81.71 -84.10 . . 0 "[ . 1 . 2 ]"
128 PSI 1 79 GLU N 1 79 GLU CA 1 79 GLU C 1 80 ALA N -31.50 8.50 3.33 -16.13 11.01 2.51 8 0 "[ . 1 . 2 ]"
129 PHI 1 79 GLU C 1 80 ALA N 1 80 ALA CA 1 80 ALA C -143.10 -11.60 -62.46 -66.93 -75.35 . . 0 "[ . 1 . 2 ]"
130 PSI 1 80 ALA N 1 80 ALA CA 1 80 ALA C 1 81 GLU N 115.40 163.90 122.43 114.16 133.10 1.24 5 0 "[ . 1 . 2 ]"
131 PHI 1 80 ALA C 1 81 GLU N 1 81 GLU CA 1 81 GLU C -152.30 -78.80 -83.13 -85.23 -85.68 3.19 17 0 "[ . 1 . 2 ]"
132 PSI 1 81 GLU N 1 81 GLU CA 1 81 GLU C 1 82 PRO N 93.40 176.30 127.34 120.78 135.05 . . 0 "[ . 1 . 2 ]"
133 PHI 1 82 PRO C 1 83 GLN N 1 83 GLN CA 1 83 GLN C -146.20 -60.50 -85.65 -83.70 -85.38 . . 0 "[ . 1 . 2 ]"
134 PSI 1 83 GLN N 1 83 GLN CA 1 83 GLN C 1 84 ALA N 83.50 -156.10 169.35 176.17 173.38 . . 0 "[ . 1 . 2 ]"
135 PHI 1 83 GLN C 1 84 ALA N 1 84 ALA CA 1 84 ALA C -79.70 -39.70 -73.80 -65.77 -69.65 . . 0 "[ . 1 . 2 ]"
136 PSI 1 84 ALA N 1 84 ALA CA 1 84 ALA C 1 85 ASP N -46.30 -6.30 -9.97 -22.32 -4.66 1.64 10 0 "[ . 1 . 2 ]"
137 PHI 1 84 ALA C 1 85 ASP N 1 85 ASP CA 1 85 ASP C -117.60 -61.50 -74.80 -89.09 -67.08 . . 0 "[ . 1 . 2 ]"
138 PSI 1 85 ASP N 1 85 ASP CA 1 85 ASP C 1 86 GLY N -17.90 22.10 -23.74 -21.05 -22.01 7.80 16 17 "[* **** * **-***+* *2**]"
139 PHI 1 85 ASP C 1 86 GLY N 1 86 GLY CA 1 86 GLY C 59.80 101.40 82.21 88.01 85.86 . . 0 "[ . 1 . 2 ]"
140 PSI 1 86 GLY N 1 86 GLY CA 1 86 GLY C 1 87 GLU N -12.00 51.70 -15.34 -12.93 -13.67 7.14 16 3 "[ . 1 *.+ 2- ]"
141 PHI 1 86 GLY C 1 87 GLU N 1 87 GLU CA 1 87 GLU C -137.10 -55.80 -117.70 -112.53 -114.76 . . 0 "[ . 1 . 2 ]"
142 PHI 1 87 GLU C 1 88 SER N 1 88 SER CA 1 88 SER C -163.40 -64.50 -90.23 -101.80 -74.17 . . 0 "[ . 1 . 2 ]"
143 PSI 1 88 SER N 1 88 SER CA 1 88 SER C 1 89 TRP N 102.90 167.50 144.32 142.64 141.69 . . 0 "[ . 1 . 2 ]"
144 PHI 1 88 SER C 1 89 TRP N 1 89 TRP CA 1 89 TRP C -166.40 -96.60 -128.67 -135.34 -115.96 . . 0 "[ . 1 . 2 ]"
145 PSI 1 89 TRP N 1 89 TRP CA 1 89 TRP C 1 90 ARG N 125.50 173.60 142.37 124.89 158.98 0.61 2 0 "[ . 1 . 2 ]"
146 PHI 1 89 TRP C 1 90 ARG N 1 90 ARG CA 1 90 ARG C -171.90 -75.00 -95.90 -84.09 -86.38 . . 0 "[ . 1 . 2 ]"
147 PSI 1 90 ARG N 1 90 ARG CA 1 90 ARG C 1 91 LEU N 96.80 150.50 105.57 107.16 105.57 . . 0 "[ . 1 . 2 ]"
148 PHI 1 90 ARG C 1 91 LEU N 1 91 LEU CA 1 91 LEU C -147.90 -92.20 -91.96 -89.62 -90.21 3.21 3 0 "[ . 1 . 2 ]"
149 PSI 1 91 LEU N 1 91 LEU CA 1 91 LEU C 1 92 THR N 102.70 157.50 103.58 99.17 98.83 5.45 13 2 "[ -. 1 + . 2 ]"
150 PHI 1 91 LEU C 1 92 THR N 1 92 THR CA 1 92 THR C -157.40 -63.30 -97.54 -85.65 -90.26 . . 0 "[ . 1 . 2 ]"
151 PSI 1 92 THR N 1 92 THR CA 1 92 THR C 1 93 THR N 97.80 180.00 119.51 109.89 103.73 0.02 4 0 "[ . 1 . 2 ]"
152 PHI 1 92 THR C 1 93 THR N 1 93 THR CA 1 93 THR C -165.60 -62.30 -121.29 -134.89 -102.27 . . 0 "[ . 1 . 2 ]"
153 PSI 1 93 THR N 1 93 THR CA 1 93 THR C 1 94 GLY N 139.50 -173.50 -176.16 178.97 176.89 2.08 19 0 "[ . 1 . 2 ]"
154 PHI 1 93 THR C 1 94 GLY N 1 94 GLY CA 1 94 GLY C -81.70 -40.40 -77.11 -74.04 -74.77 . . 0 "[ . 1 . 2 ]"
155 PSI 1 94 GLY N 1 94 GLY CA 1 94 GLY C 1 95 GLU N -47.40 1.90 -13.89 -24.65 -1.79 . . 0 "[ . 1 . 2 ]"
156 PHI 1 94 GLY C 1 95 GLU N 1 95 GLU CA 1 95 GLU C -131.00 -50.60 -85.13 -99.83 -71.82 . . 0 "[ . 1 . 2 ]"
157 PSI 1 95 GLU N 1 95 GLU CA 1 95 GLU C 1 96 GLY N -48.70 25.50 -41.79 -50.31 -2.10 1.61 2 0 "[ . 1 . 2 ]"
158 PHI 1 96 GLY C 1 97 ALA N 1 97 ALA CA 1 97 ALA C 179.40 -78.30 -136.08 -157.67 -94.26 . . 0 "[ . 1 . 2 ]"
159 PSI 1 97 ALA N 1 97 ALA CA 1 97 ALA C 1 98 TYR N 106.30 166.50 129.85 133.29 131.93 . . 0 "[ . 1 . 2 ]"
160 PHI 1 97 ALA C 1 98 TYR N 1 98 TYR CA 1 98 TYR C -158.60 -97.60 -127.44 -131.42 -131.69 . . 0 "[ . 1 . 2 ]"
161 PSI 1 98 TYR N 1 98 TYR CA 1 98 TYR C 1 99 GLN N 108.10 179.70 130.47 115.01 164.36 . . 0 "[ . 1 . 2 ]"
162 PHI 1 98 TYR C 1 99 GLN N 1 99 GLN CA 1 99 GLN C -145.20 -83.20 -92.07 -85.62 -86.54 . . 0 "[ . 1 . 2 ]"
163 PSI 1 99 GLN N 1 99 GLN CA 1 99 GLN C 1 100 LEU N 103.80 144.40 103.17 101.71 101.60 5.14 12 1 "[ . 1 + . 2 ]"
164 PHI 1 99 GLN C 1 100 LEU N 1 100 LEU CA 1 100 LEU C -135.10 -95.10 -92.55 -92.49 -92.86 5.39 21 1 "[ . 1 . 2+ ]"
165 PSI 1 100 LEU N 1 100 LEU CA 1 100 LEU C 1 101 ARG N 112.40 164.50 111.78 106.51 123.25 5.89 11 1 "[ . 1+ . 2 ]"
166 PHI 1 100 LEU C 1 101 ARG N 1 101 ARG CA 1 101 ARG C -143.70 -103.40 -114.28 -112.77 -114.70 . . 0 "[ . 1 . 2 ]"
167 PSI 1 101 ARG N 1 101 ARG CA 1 101 ARG C 1 102 CYS N 108.60 148.60 119.54 111.82 108.46 0.14 1 0 "[ . 1 . 2 ]"
168 PHI 1 101 ARG C 1 102 CYS N 1 102 CYS CA 1 102 CYS C -125.10 -83.90 -84.83 -92.69 -82.20 1.70 11 0 "[ . 1 . 2 ]"
169 PSI 1 102 CYS N 1 102 CYS CA 1 102 CYS C 1 103 LEU N 109.40 149.70 123.39 111.95 133.60 . . 0 "[ . 1 . 2 ]"
170 PHI 1 102 CYS C 1 103 LEU N 1 103 LEU CA 1 103 LEU C -151.60 -46.70 -123.05 -138.08 -102.60 . . 0 "[ . 1 . 2 ]"
171 PSI 1 103 LEU N 1 103 LEU CA 1 103 LEU C 1 104 GLY N 92.30 -177.10 146.30 149.90 145.86 0.50 8 0 "[ . 1 . 2 ]"
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