NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
521359 |
2l48   |
17233 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2l48
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 220
_TA_constraint_stats_list.Viol_count 1160
_TA_constraint_stats_list.Viol_total 19278.46
_TA_constraint_stats_list.Viol_max 4.16
_TA_constraint_stats_list.Viol_rms 0.52
_TA_constraint_stats_list.Viol_average_all_restraints 0.22
_TA_constraint_stats_list.Viol_average_violations_only 0.83
_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 14 THR C 1 15 SER N 1 15 SER CA 1 15 SER C -127.00 -69.00 -98.53 -128.05 -66.62 2.38 17 0 "[ . 1 . 2]"
2 PSI 1 15 SER N 1 15 SER CA 1 15 SER C 1 16 PRO N 122.00 150.00 135.14 119.28 151.77 2.72 12 0 "[ . 1 . 2]"
3 PSI 1 16 PRO N 1 16 PRO CA 1 16 PRO C 1 17 THR N 136.00 156.00 146.45 133.73 159.09 3.09 12 0 "[ . 1 . 2]"
4 PHI 1 20 ASN C 1 21 ILE N 1 21 ILE CA 1 21 ILE C -158.00 -84.00 -117.08 -146.03 -103.74 . . 0 "[ . 1 . 2]"
5 PSI 1 21 ILE N 1 21 ILE CA 1 21 ILE C 1 22 ILE N 123.00 169.00 148.32 138.71 155.19 . . 0 "[ . 1 . 2]"
6 PHI 1 21 ILE C 1 22 ILE N 1 22 ILE CA 1 22 ILE C -142.00 -106.00 -132.91 -139.22 -121.57 . . 0 "[ . 1 . 2]"
7 PSI 1 22 ILE N 1 22 ILE CA 1 22 ILE C 1 23 GLN N 125.00 155.00 134.94 133.13 131.29 . . 0 "[ . 1 . 2]"
8 PHI 1 22 ILE C 1 23 GLN N 1 23 GLN CA 1 23 GLN C -124.00 -98.00 -122.38 -124.30 -119.00 0.30 19 0 "[ . 1 . 2]"
9 PSI 1 23 GLN N 1 23 GLN CA 1 23 GLN C 1 24 SER N 119.00 139.00 138.35 140.17 140.08 2.06 8 0 "[ . 1 . 2]"
10 PHI 1 23 GLN C 1 24 SER N 1 24 SER CA 1 24 SER C -138.00 -86.00 -103.69 -104.63 -105.21 . . 0 "[ . 1 . 2]"
11 PSI 1 24 SER N 1 24 SER CA 1 24 SER C 1 25 GLY N 130.00 172.00 171.11 171.08 170.51 0.36 4 0 "[ . 1 . 2]"
12 PHI 1 25 GLY C 1 26 ALA N 1 26 ALA CA 1 26 ALA C -99.00 -65.00 -67.41 -75.17 -64.41 0.59 18 0 "[ . 1 . 2]"
13 PSI 1 26 ALA N 1 26 ALA CA 1 26 ALA C 1 27 PHE N 118.00 152.00 119.04 117.21 123.56 0.79 2 0 "[ . 1 . 2]"
14 PHI 1 26 ALA C 1 27 PHE N 1 27 PHE CA 1 27 PHE C -149.00 -117.00 -121.82 -119.96 -120.59 0.15 4 0 "[ . 1 . 2]"
15 PSI 1 27 PHE N 1 27 PHE CA 1 27 PHE C 1 28 SER N 131.00 177.00 173.41 172.68 171.92 0.53 18 0 "[ . 1 . 2]"
16 PSI 1 28 SER N 1 28 SER CA 1 28 SER C 1 29 PRO N 129.00 167.00 132.82 128.33 138.91 0.67 10 0 "[ . 1 . 2]"
17 PSI 1 29 PRO N 1 29 PRO CA 1 29 PRO C 1 30 TYR N -44.00 -30.00 -28.37 -28.95 -27.76 2.24 10 0 "[ . 1 . 2]"
18 PHI 1 29 PRO C 1 30 TYR N 1 30 TYR CA 1 30 TYR C -76.00 -56.00 -73.36 -76.35 -70.80 0.35 15 0 "[ . 1 . 2]"
19 PSI 1 30 TYR N 1 30 TYR CA 1 30 TYR C 1 31 GLU N -39.00 -19.00 -17.71 -18.68 -16.55 2.45 15 0 "[ . 1 . 2]"
20 PHI 1 30 TYR C 1 31 GLU N 1 31 GLU CA 1 31 GLU C -92.00 -64.00 -86.13 -87.22 -89.26 . . 0 "[ . 1 . 2]"
21 PHI 1 31 GLU C 1 32 THR N 1 32 THR CA 1 32 THR C -72.00 -52.00 -51.92 -51.53 -51.70 1.36 11 0 "[ . 1 . 2]"
22 PSI 1 32 THR N 1 32 THR CA 1 32 THR C 1 33 PRO N -51.00 -27.00 -50.70 -52.22 -48.82 1.22 20 0 "[ . 1 . 2]"
23 PSI 1 33 PRO N 1 33 PRO CA 1 33 PRO C 1 34 ASP N -47.00 -39.00 -39.64 -40.69 -41.34 1.26 19 0 "[ . 1 . 2]"
24 PHI 1 33 PRO C 1 34 ASP N 1 34 ASP CA 1 34 ASP C -73.00 -53.00 -71.30 -72.46 -73.33 1.01 1 0 "[ . 1 . 2]"
25 PSI 1 34 ASP N 1 34 ASP CA 1 34 ASP C 1 35 VAL N -53.00 -33.00 -41.43 -39.14 -40.46 . . 0 "[ . 1 . 2]"
26 PHI 1 34 ASP C 1 35 VAL N 1 35 VAL CA 1 35 VAL C -75.00 -55.00 -64.71 -66.78 -67.72 0.19 5 0 "[ . 1 . 2]"
27 PSI 1 35 VAL N 1 35 VAL CA 1 35 VAL C 1 36 MET N -56.00 -36.00 -40.83 -44.97 -34.62 1.38 20 0 "[ . 1 . 2]"
28 PHI 1 35 VAL C 1 36 MET N 1 36 MET CA 1 36 MET C -73.00 -53.00 -61.72 -63.29 -58.97 . . 0 "[ . 1 . 2]"
29 PSI 1 36 MET N 1 36 MET CA 1 36 MET C 1 37 GLY N -53.00 -33.00 -36.63 -35.89 -36.42 0.17 12 0 "[ . 1 . 2]"
30 PHI 1 36 MET C 1 37 GLY N 1 37 GLY CA 1 37 GLY C -75.00 -55.00 -63.33 -68.95 -59.96 . . 0 "[ . 1 . 2]"
31 PSI 1 37 GLY N 1 37 GLY CA 1 37 GLY C 1 38 ALA N -47.00 -27.00 -41.02 -42.88 -43.41 . . 0 "[ . 1 . 2]"
32 PHI 1 37 GLY C 1 38 ALA N 1 38 ALA CA 1 38 ALA C -74.00 -54.00 -62.67 -67.93 -58.73 . . 0 "[ . 1 . 2]"
33 PSI 1 38 ALA N 1 38 ALA CA 1 38 ALA C 1 39 LEU N -50.00 -28.00 -49.13 -47.35 -48.37 0.73 8 0 "[ . 1 . 2]"
34 PHI 1 38 ALA C 1 39 LEU N 1 39 LEU CA 1 39 LEU C -74.00 -54.00 -59.05 -60.35 -60.57 . . 0 "[ . 1 . 2]"
35 PSI 1 39 LEU N 1 39 LEU CA 1 39 LEU C 1 40 THR N -48.00 -28.00 -39.21 -37.99 -38.58 . . 0 "[ . 1 . 2]"
36 PHI 1 39 LEU C 1 40 THR N 1 40 THR CA 1 40 THR C -77.00 -57.00 -67.63 -75.21 -61.04 . . 0 "[ . 1 . 2]"
37 PSI 1 40 THR N 1 40 THR CA 1 40 THR C 1 41 SER N -52.00 -32.00 -43.39 -52.12 -33.38 0.12 16 0 "[ . 1 . 2]"
38 PHI 1 40 THR C 1 41 SER N 1 41 SER CA 1 41 SER C -77.00 -57.00 -70.02 -67.23 -67.83 0.21 9 0 "[ . 1 . 2]"
39 PSI 1 41 SER N 1 41 SER CA 1 41 SER C 1 42 LEU N -40.00 -18.00 -34.45 -40.21 -25.91 0.21 3 0 "[ . 1 . 2]"
40 PHI 1 41 SER C 1 42 LEU N 1 42 LEU CA 1 42 LEU C -101.00 -81.00 -89.70 -87.45 -89.18 0.21 17 0 "[ . 1 . 2]"
41 PSI 1 42 LEU N 1 42 LEU CA 1 42 LEU C 1 43 LYS N -4.00 16.00 3.21 -4.52 13.11 0.52 8 0 "[ . 1 . 2]"
42 PHI 1 42 LEU C 1 43 LYS N 1 43 LYS CA 1 43 LYS C 46.00 66.00 52.11 51.56 50.12 1.35 4 0 "[ . 1 . 2]"
43 PSI 1 43 LYS N 1 43 LYS CA 1 43 LYS C 1 44 MET N 26.00 48.00 36.51 25.66 49.62 1.62 9 0 "[ . 1 . 2]"
44 PHI 1 45 THR C 1 46 ALA N 1 46 ALA CA 1 46 ALA C -161.00 -137.00 -143.07 -143.41 -145.12 0.45 18 0 "[ . 1 . 2]"
45 PSI 1 46 ALA N 1 46 ALA CA 1 46 ALA C 1 47 ASP N 138.00 164.00 161.09 160.51 160.02 0.54 3 0 "[ . 1 . 2]"
46 PHI 1 46 ALA C 1 47 ASP N 1 47 ASP CA 1 47 ASP C -135.00 -101.00 -102.02 -105.47 -99.81 1.19 3 0 "[ . 1 . 2]"
47 PSI 1 47 ASP N 1 47 ASP CA 1 47 ASP C 1 48 PHE N 116.00 140.00 117.47 115.07 121.16 0.93 16 0 "[ . 1 . 2]"
48 PHI 1 47 ASP C 1 48 PHE N 1 48 PHE CA 1 48 PHE C -113.00 -87.00 -98.04 -102.60 -93.53 . . 0 "[ . 1 . 2]"
49 PSI 1 48 PHE N 1 48 PHE CA 1 48 PHE C 1 49 ILE N 111.00 131.00 112.12 114.70 112.04 0.64 9 0 "[ . 1 . 2]"
50 PHI 1 48 PHE C 1 49 ILE N 1 49 ILE CA 1 49 ILE C -123.00 -95.00 -96.52 -102.20 -94.61 0.39 20 0 "[ . 1 . 2]"
51 PSI 1 49 ILE N 1 49 ILE CA 1 49 ILE C 1 50 LEU N 113.00 133.00 120.99 123.07 122.27 . . 0 "[ . 1 . 2]"
52 PHI 1 49 ILE C 1 50 LEU N 1 50 LEU CA 1 50 LEU C -117.00 -87.00 -86.77 -93.41 -85.02 1.98 17 0 "[ . 1 . 2]"
53 PSI 1 50 LEU N 1 50 LEU CA 1 50 LEU C 1 51 GLN N 119.00 155.00 126.87 118.90 137.03 0.10 9 0 "[ . 1 . 2]"
54 PHI 1 50 LEU C 1 51 GLN N 1 51 GLN CA 1 51 GLN C -94.00 -74.00 -93.83 -96.17 -87.94 2.17 10 0 "[ . 1 . 2]"
55 PSI 1 51 GLN N 1 51 GLN CA 1 51 GLN C 1 52 SER N 151.00 175.00 159.11 156.56 162.37 . . 0 "[ . 1 . 2]"
56 PHI 1 51 GLN C 1 52 SER N 1 52 SER CA 1 52 SER C -70.00 -50.00 -67.93 -69.24 -70.09 0.76 17 0 "[ . 1 . 2]"
57 PSI 1 52 SER N 1 52 SER CA 1 52 SER C 1 53 ASP N -37.00 -17.00 -16.09 -16.99 -15.07 1.93 10 0 "[ . 1 . 2]"
58 PHI 1 52 SER C 1 53 ASP N 1 53 ASP CA 1 53 ASP C -103.00 -77.00 -77.94 -85.81 -75.66 1.34 4 0 "[ . 1 . 2]"
59 PSI 1 53 ASP N 1 53 ASP CA 1 53 ASP C 1 54 GLY N -15.00 17.00 -13.83 -16.13 -6.50 1.13 15 0 "[ . 1 . 2]"
60 PHI 1 53 ASP C 1 54 GLY N 1 54 GLY CA 1 54 GLY C 70.00 98.00 97.00 95.16 94.87 0.99 17 0 "[ . 1 . 2]"
61 PSI 1 54 GLY N 1 54 GLY CA 1 54 GLY C 1 55 LEU N -1.00 31.00 21.90 31.69 31.37 0.69 2 0 "[ . 1 . 2]"
62 PHI 1 55 LEU C 1 56 THR N 1 56 THR CA 1 56 THR C -153.00 -117.00 -133.35 -133.74 -134.17 . . 0 "[ . 1 . 2]"
63 PSI 1 56 THR N 1 56 THR CA 1 56 THR C 1 57 TYR N 140.00 162.00 158.67 149.29 162.52 0.52 8 0 "[ . 1 . 2]"
64 PHI 1 56 THR C 1 57 TYR N 1 57 TYR CA 1 57 TYR C -153.00 -123.00 -140.71 -139.94 -140.81 . . 0 "[ . 1 . 2]"
65 PSI 1 57 TYR N 1 57 TYR CA 1 57 TYR C 1 58 PHE N 145.00 173.00 151.63 146.21 159.06 . . 0 "[ . 1 . 2]"
66 PHI 1 57 TYR C 1 58 PHE N 1 58 PHE CA 1 58 PHE C -153.00 -117.00 -118.21 -123.81 -116.35 0.65 20 0 "[ . 1 . 2]"
67 PSI 1 58 PHE N 1 58 PHE CA 1 58 PHE C 1 59 ILE N 135.00 163.00 149.28 145.86 154.52 . . 0 "[ . 1 . 2]"
68 PHI 1 58 PHE C 1 59 ILE N 1 59 ILE CA 1 59 ILE C -133.00 -109.00 -119.49 -119.51 -120.68 . . 0 "[ . 1 . 2]"
69 PSI 1 59 ILE N 1 59 ILE CA 1 59 ILE C 1 60 SER N 120.00 140.00 118.28 118.34 118.24 2.97 16 0 "[ . 1 . 2]"
70 PHI 1 59 ILE C 1 60 SER N 1 60 SER CA 1 60 SER C -121.00 -69.00 -87.54 -87.14 -88.26 . . 0 "[ . 1 . 2]"
71 PSI 1 60 SER N 1 60 SER CA 1 60 SER C 1 61 LYS N 124.00 154.00 147.48 143.55 134.71 2.08 14 0 "[ . 1 . 2]"
72 PHI 1 60 SER C 1 61 LYS N 1 61 LYS CA 1 61 LYS C -76.00 -52.00 -75.65 -77.01 -77.14 1.39 1 0 "[ . 1 . 2]"
73 PHI 1 63 THR C 1 64 SER N 1 64 SER CA 1 64 SER C -91.00 -71.00 -88.22 -89.73 -91.07 0.56 13 0 "[ . 1 . 2]"
74 PSI 1 64 SER N 1 64 SER CA 1 64 SER C 1 65 ASP N 155.00 175.00 159.19 153.92 168.63 1.08 14 0 "[ . 1 . 2]"
75 PHI 1 64 SER C 1 65 ASP N 1 65 ASP CA 1 65 ASP C -70.00 -50.00 -61.07 -54.14 -57.03 . . 0 "[ . 1 . 2]"
76 PSI 1 65 ASP N 1 65 ASP CA 1 65 ASP C 1 66 ALA N -46.00 -26.00 -34.65 -46.08 -28.16 0.08 2 0 "[ . 1 . 2]"
77 PHI 1 65 ASP C 1 66 ALA N 1 66 ALA CA 1 66 ALA C -73.00 -53.00 -62.32 -65.04 -66.20 0.24 9 0 "[ . 1 . 2]"
78 PSI 1 66 ALA N 1 66 ALA CA 1 66 ALA C 1 67 GLN N -49.00 -29.00 -39.70 -40.12 -41.16 0.09 15 0 "[ . 1 . 2]"
79 PHI 1 66 ALA C 1 67 GLN N 1 67 GLN CA 1 67 GLN C -76.00 -56.00 -76.67 -75.28 -75.87 1.93 9 0 "[ . 1 . 2]"
80 PSI 1 67 GLN N 1 67 GLN CA 1 67 GLN C 1 68 LEU N -52.00 -32.00 -45.91 -53.49 -36.57 1.49 10 0 "[ . 1 . 2]"
81 PHI 1 67 GLN C 1 68 LEU N 1 68 LEU CA 1 68 LEU C -71.00 -51.00 -54.48 -64.23 -49.52 1.48 7 0 "[ . 1 . 2]"
82 PSI 1 68 LEU N 1 68 LEU CA 1 68 LEU C 1 69 LYS N -57.00 -37.00 -47.19 -57.30 -33.27 3.73 17 0 "[ . 1 . 2]"
83 PHI 1 68 LEU C 1 69 LYS N 1 69 LYS CA 1 69 LYS C -73.00 -53.00 -57.34 -61.95 -51.12 1.88 17 0 "[ . 1 . 2]"
84 PSI 1 69 LYS N 1 69 LYS CA 1 69 LYS C 1 70 ALA N -53.00 -33.00 -40.55 -36.28 -38.07 0.91 2 0 "[ . 1 . 2]"
85 PHI 1 69 LYS C 1 70 ALA N 1 70 ALA CA 1 70 ALA C -75.00 -55.00 -70.76 -74.93 -75.31 0.42 13 0 "[ . 1 . 2]"
86 PSI 1 70 ALA N 1 70 ALA CA 1 70 ALA C 1 71 MET N -50.00 -30.00 -35.07 -41.90 -29.07 0.93 11 0 "[ . 1 . 2]"
87 PHI 1 70 ALA C 1 71 MET N 1 71 MET CA 1 71 MET C -77.00 -57.00 -71.58 -73.69 -75.66 0.28 12 0 "[ . 1 . 2]"
88 PSI 1 71 MET N 1 71 MET CA 1 71 MET C 1 72 LYS N -47.00 -27.00 -41.69 -43.36 -44.27 0.50 5 0 "[ . 1 . 2]"
89 PHI 1 71 MET C 1 72 LYS N 1 72 LYS CA 1 72 LYS C -72.00 -52.00 -65.19 -65.83 -66.73 . . 0 "[ . 1 . 2]"
90 PSI 1 72 LYS N 1 72 LYS CA 1 72 LYS C 1 73 GLU N -54.00 -34.00 -38.25 -33.91 -33.98 1.47 16 0 "[ . 1 . 2]"
91 PHI 1 72 LYS C 1 73 GLU N 1 73 GLU CA 1 73 GLU C -74.00 -54.00 -62.40 -67.62 -53.89 0.11 4 0 "[ . 1 . 2]"
92 PSI 1 73 GLU N 1 73 GLU CA 1 73 GLU C 1 74 TYR N -50.00 -30.00 -34.74 -43.27 -28.56 1.44 6 0 "[ . 1 . 2]"
93 PHI 1 73 GLU C 1 74 TYR N 1 74 TYR CA 1 74 TYR C -73.00 -53.00 -64.58 -64.44 -66.04 0.23 19 0 "[ . 1 . 2]"
94 PSI 1 74 TYR N 1 74 TYR CA 1 74 TYR C 1 75 LEU N -54.00 -34.00 -48.82 -54.10 -44.64 0.10 20 0 "[ . 1 . 2]"
95 PHI 1 74 TYR C 1 75 LEU N 1 75 LEU CA 1 75 LEU C -72.00 -52.00 -64.17 -67.67 -60.69 . . 0 "[ . 1 . 2]"
96 PSI 1 75 LEU N 1 75 LEU CA 1 75 LEU C 1 76 ASP N -51.00 -31.00 -33.10 -38.59 -30.65 0.35 12 0 "[ . 1 . 2]"
97 PHI 1 75 LEU C 1 76 ASP N 1 76 ASP CA 1 76 ASP C -75.00 -55.00 -67.59 -72.88 -60.16 . . 0 "[ . 1 . 2]"
98 PSI 1 76 ASP N 1 76 ASP CA 1 76 ASP C 1 77 ARG N -48.00 -28.00 -33.36 -32.52 -32.59 0.48 13 0 "[ . 1 . 2]"
99 PHI 1 76 ASP C 1 77 ARG N 1 77 ARG CA 1 77 ARG C -76.00 -56.00 -70.84 -77.10 -64.37 1.10 6 0 "[ . 1 . 2]"
100 PSI 1 77 ARG N 1 77 ARG CA 1 77 ARG C 1 78 LYS N -47.00 -25.00 -30.25 -30.91 -31.74 0.44 8 0 "[ . 1 . 2]"
101 PHI 1 77 ARG C 1 78 LYS N 1 78 LYS CA 1 78 LYS C -103.00 -81.00 -85.44 -91.73 -80.21 0.79 14 0 "[ . 1 . 2]"
102 PSI 1 78 LYS N 1 78 LYS CA 1 78 LYS C 1 79 GLY N -6.00 22.00 -8.40 -10.10 -5.82 4.10 11 0 "[ . 1 . 2]"
103 PHI 1 78 LYS C 1 79 GLY N 1 79 GLY CA 1 79 GLY C 68.00 92.00 67.99 66.61 70.52 1.39 11 0 "[ . 1 . 2]"
104 PSI 1 79 GLY N 1 79 GLY CA 1 79 GLY C 1 80 TRP N -8.00 30.00 23.47 25.70 24.30 0.69 11 0 "[ . 1 . 2]"
105 PHI 1 79 GLY C 1 80 TRP N 1 80 TRP CA 1 80 TRP C -136.00 -82.00 -88.96 -99.88 -80.85 1.15 15 0 "[ . 1 . 2]"
106 PSI 1 80 TRP N 1 80 TRP CA 1 80 TRP C 1 81 TRP N 117.00 155.00 153.44 147.06 156.28 1.28 1 0 "[ . 1 . 2]"
107 PHI 1 82 TYR C 1 83 GLU N 1 83 GLU CA 1 83 GLU C -156.00 -130.00 -128.91 -128.59 -128.89 1.82 5 0 "[ . 1 . 2]"
108 PSI 1 83 GLU N 1 83 GLU CA 1 83 GLU C 1 84 VAL N 138.00 168.00 139.60 145.52 141.26 1.19 10 0 "[ . 1 . 2]"
109 PHI 1 83 GLU C 1 84 VAL N 1 84 VAL CA 1 84 VAL C -126.00 -92.00 -102.53 -116.59 -91.42 0.58 8 0 "[ . 1 . 2]"
110 PSI 1 84 VAL N 1 84 VAL CA 1 84 VAL C 1 85 LYS N 116.00 146.00 115.55 114.25 119.06 1.75 9 0 "[ . 1 . 2]"
111 PHI 2 14 THR C 2 15 SER N 2 15 SER CA 2 15 SER C -127.00 -69.00 -94.27 -126.54 -67.70 1.30 15 0 "[ . 1 . 2]"
112 PSI 2 15 SER N 2 15 SER CA 2 15 SER C 2 16 PRO N 122.00 150.00 136.06 119.44 151.59 2.56 4 0 "[ . 1 . 2]"
113 PSI 2 16 PRO N 2 16 PRO CA 2 16 PRO C 2 17 THR N 136.00 156.00 140.85 132.03 157.02 3.97 13 0 "[ . 1 . 2]"
114 PHI 2 20 ASN C 2 21 ILE N 2 21 ILE CA 2 21 ILE C -158.00 -84.00 -116.47 -130.44 -99.45 . . 0 "[ . 1 . 2]"
115 PSI 2 21 ILE N 2 21 ILE CA 2 21 ILE C 2 22 ILE N 123.00 169.00 151.47 150.00 149.44 . . 0 "[ . 1 . 2]"
116 PHI 2 21 ILE C 2 22 ILE N 2 22 ILE CA 2 22 ILE C -142.00 -106.00 -134.44 -142.09 -117.55 0.09 3 0 "[ . 1 . 2]"
117 PSI 2 22 ILE N 2 22 ILE CA 2 22 ILE C 2 23 GLN N 125.00 155.00 133.79 128.23 124.60 0.40 1 0 "[ . 1 . 2]"
118 PHI 2 22 ILE C 2 23 GLN N 2 23 GLN CA 2 23 GLN C -124.00 -98.00 -122.12 -124.64 -114.55 0.64 3 0 "[ . 1 . 2]"
119 PSI 2 23 GLN N 2 23 GLN CA 2 23 GLN C 2 24 SER N 119.00 139.00 136.38 140.14 139.88 2.01 5 0 "[ . 1 . 2]"
120 PHI 2 23 GLN C 2 24 SER N 2 24 SER CA 2 24 SER C -138.00 -86.00 -103.53 -102.28 -102.37 . . 0 "[ . 1 . 2]"
121 PSI 2 24 SER N 2 24 SER CA 2 24 SER C 2 25 GLY N 130.00 172.00 170.44 164.88 172.48 0.48 19 0 "[ . 1 . 2]"
122 PHI 2 25 GLY C 2 26 ALA N 2 26 ALA CA 2 26 ALA C -99.00 -65.00 -67.80 -76.12 -64.16 0.84 8 0 "[ . 1 . 2]"
123 PSI 2 26 ALA N 2 26 ALA CA 2 26 ALA C 2 27 PHE N 118.00 152.00 119.01 116.85 125.10 1.15 11 0 "[ . 1 . 2]"
124 PHI 2 26 ALA C 2 27 PHE N 2 27 PHE CA 2 27 PHE C -149.00 -117.00 -121.65 -119.55 -120.47 0.27 18 0 "[ . 1 . 2]"
125 PSI 2 27 PHE N 2 27 PHE CA 2 27 PHE C 2 28 SER N 131.00 177.00 175.70 177.15 177.10 0.92 17 0 "[ . 1 . 2]"
126 PSI 2 28 SER N 2 28 SER CA 2 28 SER C 2 29 PRO N 129.00 167.00 132.19 128.24 137.36 0.76 3 0 "[ . 1 . 2]"
127 PSI 2 29 PRO N 2 29 PRO CA 2 29 PRO C 2 30 TYR N -44.00 -30.00 -28.45 -29.25 -28.03 1.97 14 0 "[ . 1 . 2]"
128 PHI 2 29 PRO C 2 30 TYR N 2 30 TYR CA 2 30 TYR C -76.00 -56.00 -74.23 -73.13 -73.30 0.26 8 0 "[ . 1 . 2]"
129 PSI 2 30 TYR N 2 30 TYR CA 2 30 TYR C 2 31 GLU N -39.00 -19.00 -17.77 -18.88 -16.78 2.22 7 0 "[ . 1 . 2]"
130 PHI 2 30 TYR C 2 31 GLU N 2 31 GLU CA 2 31 GLU C -92.00 -64.00 -86.61 -87.00 -88.33 . . 0 "[ . 1 . 2]"
131 PHI 2 31 GLU C 2 32 THR N 2 32 THR CA 2 32 THR C -72.00 -52.00 -51.42 -51.52 -51.71 1.49 11 0 "[ . 1 . 2]"
132 PSI 2 32 THR N 2 32 THR CA 2 32 THR C 2 33 PRO N -51.00 -27.00 -50.26 -51.81 -48.66 0.81 14 0 "[ . 1 . 2]"
133 PSI 2 33 PRO N 2 33 PRO CA 2 33 PRO C 2 34 ASP N -47.00 -39.00 -40.59 -45.99 -38.14 0.86 1 0 "[ . 1 . 2]"
134 PHI 2 33 PRO C 2 34 ASP N 2 34 ASP CA 2 34 ASP C -73.00 -53.00 -72.16 -73.17 -73.32 1.66 11 0 "[ . 1 . 2]"
135 PSI 2 34 ASP N 2 34 ASP CA 2 34 ASP C 2 35 VAL N -53.00 -33.00 -40.31 -40.57 -42.10 . . 0 "[ . 1 . 2]"
136 PHI 2 34 ASP C 2 35 VAL N 2 35 VAL CA 2 35 VAL C -75.00 -55.00 -63.28 -63.64 -65.23 0.33 14 0 "[ . 1 . 2]"
137 PSI 2 35 VAL N 2 35 VAL CA 2 35 VAL C 2 36 MET N -56.00 -36.00 -41.58 -46.68 -34.87 1.13 14 0 "[ . 1 . 2]"
138 PHI 2 35 VAL C 2 36 MET N 2 36 MET CA 2 36 MET C -73.00 -53.00 -61.79 -60.55 -61.48 . . 0 "[ . 1 . 2]"
139 PSI 2 36 MET N 2 36 MET CA 2 36 MET C 2 37 GLY N -53.00 -33.00 -37.86 -40.73 -33.87 . . 0 "[ . 1 . 2]"
140 PHI 2 36 MET C 2 37 GLY N 2 37 GLY CA 2 37 GLY C -75.00 -55.00 -62.53 -65.74 -67.79 . . 0 "[ . 1 . 2]"
141 PSI 2 37 GLY N 2 37 GLY CA 2 37 GLY C 2 38 ALA N -47.00 -27.00 -41.93 -43.46 -43.58 0.15 8 0 "[ . 1 . 2]"
142 PHI 2 37 GLY C 2 38 ALA N 2 38 ALA CA 2 38 ALA C -74.00 -54.00 -61.95 -65.63 -57.46 . . 0 "[ . 1 . 2]"
143 PSI 2 38 ALA N 2 38 ALA CA 2 38 ALA C 2 39 LEU N -50.00 -28.00 -48.51 -50.69 -42.01 0.69 20 0 "[ . 1 . 2]"
144 PHI 2 38 ALA C 2 39 LEU N 2 39 LEU CA 2 39 LEU C -74.00 -54.00 -60.41 -60.61 -61.27 . . 0 "[ . 1 . 2]"
145 PSI 2 39 LEU N 2 39 LEU CA 2 39 LEU C 2 40 THR N -48.00 -28.00 -37.33 -41.32 -43.53 . . 0 "[ . 1 . 2]"
146 PHI 2 39 LEU C 2 40 THR N 2 40 THR CA 2 40 THR C -77.00 -57.00 -68.11 -75.26 -59.66 . . 0 "[ . 1 . 2]"
147 PSI 2 40 THR N 2 40 THR CA 2 40 THR C 2 41 SER N -52.00 -32.00 -43.17 -51.36 -31.36 0.64 13 0 "[ . 1 . 2]"
148 PHI 2 40 THR C 2 41 SER N 2 41 SER CA 2 41 SER C -77.00 -57.00 -70.02 -72.80 -76.31 0.33 13 0 "[ . 1 . 2]"
149 PSI 2 41 SER N 2 41 SER CA 2 41 SER C 2 42 LEU N -40.00 -18.00 -35.88 -38.17 -40.06 1.12 10 0 "[ . 1 . 2]"
150 PHI 2 41 SER C 2 42 LEU N 2 42 LEU CA 2 42 LEU C -101.00 -81.00 -89.75 -98.04 -80.86 0.14 20 0 "[ . 1 . 2]"
151 PSI 2 42 LEU N 2 42 LEU CA 2 42 LEU C 2 43 LYS N -4.00 16.00 3.16 -4.63 9.28 0.63 14 0 "[ . 1 . 2]"
152 PHI 2 42 LEU C 2 43 LYS N 2 43 LYS CA 2 43 LYS C 46.00 66.00 52.20 45.44 58.93 0.56 4 0 "[ . 1 . 2]"
153 PSI 2 43 LYS N 2 43 LYS CA 2 43 LYS C 2 44 MET N 26.00 48.00 35.96 25.20 49.82 1.82 14 0 "[ . 1 . 2]"
154 PHI 2 45 THR C 2 46 ALA N 2 46 ALA CA 2 46 ALA C -161.00 -137.00 -144.46 -148.05 -153.37 0.03 18 0 "[ . 1 . 2]"
155 PSI 2 46 ALA N 2 46 ALA CA 2 46 ALA C 2 47 ASP N 138.00 164.00 161.17 156.08 164.43 0.43 1 0 "[ . 1 . 2]"
156 PHI 2 46 ALA C 2 47 ASP N 2 47 ASP CA 2 47 ASP C -135.00 -101.00 -101.59 -104.02 -105.23 0.72 19 0 "[ . 1 . 2]"
157 PSI 2 47 ASP N 2 47 ASP CA 2 47 ASP C 2 48 PHE N 116.00 140.00 117.75 126.70 124.30 0.97 5 0 "[ . 1 . 2]"
158 PHI 2 47 ASP C 2 48 PHE N 2 48 PHE CA 2 48 PHE C -113.00 -87.00 -98.18 -101.25 -101.51 . . 0 "[ . 1 . 2]"
159 PSI 2 48 PHE N 2 48 PHE CA 2 48 PHE C 2 49 ILE N 111.00 131.00 112.00 114.44 112.96 0.80 20 0 "[ . 1 . 2]"
160 PHI 2 48 PHE C 2 49 ILE N 2 49 ILE CA 2 49 ILE C -123.00 -95.00 -96.49 -95.69 -96.47 0.77 15 0 "[ . 1 . 2]"
161 PSI 2 49 ILE N 2 49 ILE CA 2 49 ILE C 2 50 LEU N 113.00 133.00 120.74 121.62 121.27 . . 0 "[ . 1 . 2]"
162 PHI 2 49 ILE C 2 50 LEU N 2 50 LEU CA 2 50 LEU C -117.00 -87.00 -86.51 -86.33 -86.51 2.10 14 0 "[ . 1 . 2]"
163 PSI 2 50 LEU N 2 50 LEU CA 2 50 LEU C 2 51 GLN N 119.00 155.00 128.05 118.46 136.50 0.54 5 0 "[ . 1 . 2]"
164 PHI 2 50 LEU C 2 51 GLN N 2 51 GLN CA 2 51 GLN C -94.00 -74.00 -93.84 -94.14 -94.57 1.56 20 0 "[ . 1 . 2]"
165 PSI 2 51 GLN N 2 51 GLN CA 2 51 GLN C 2 52 SER N 151.00 175.00 160.08 154.38 166.36 . . 0 "[ . 1 . 2]"
166 PHI 2 51 GLN C 2 52 SER N 2 52 SER CA 2 52 SER C -70.00 -50.00 -66.68 -65.98 -66.79 0.59 18 0 "[ . 1 . 2]"
167 PSI 2 52 SER N 2 52 SER CA 2 52 SER C 2 53 ASP N -37.00 -17.00 -17.41 -25.29 -15.24 1.76 20 0 "[ . 1 . 2]"
168 PHI 2 52 SER C 2 53 ASP N 2 53 ASP CA 2 53 ASP C -103.00 -77.00 -79.48 -89.96 -75.66 1.34 9 0 "[ . 1 . 2]"
169 PSI 2 53 ASP N 2 53 ASP CA 2 53 ASP C 2 54 GLY N -15.00 17.00 -14.43 -9.52 -12.42 1.98 5 0 "[ . 1 . 2]"
170 PHI 2 53 ASP C 2 54 GLY N 2 54 GLY CA 2 54 GLY C 70.00 98.00 98.25 95.41 101.19 3.19 14 0 "[ . 1 . 2]"
171 PSI 2 54 GLY N 2 54 GLY CA 2 54 GLY C 2 55 LEU N -1.00 31.00 22.08 31.43 30.37 0.76 16 0 "[ . 1 . 2]"
172 PHI 2 55 LEU C 2 56 THR N 2 56 THR CA 2 56 THR C -153.00 -117.00 -134.25 -142.36 -126.47 . . 0 "[ . 1 . 2]"
173 PSI 2 56 THR N 2 56 THR CA 2 56 THR C 2 57 TYR N 140.00 162.00 157.57 162.13 161.45 0.27 14 0 "[ . 1 . 2]"
174 PHI 2 56 THR C 2 57 TYR N 2 57 TYR CA 2 57 TYR C -153.00 -123.00 -139.68 -147.37 -131.07 . . 0 "[ . 1 . 2]"
175 PSI 2 57 TYR N 2 57 TYR CA 2 57 TYR C 2 58 PHE N 145.00 173.00 151.44 147.10 159.23 . . 0 "[ . 1 . 2]"
176 PHI 2 57 TYR C 2 58 PHE N 2 58 PHE CA 2 58 PHE C -153.00 -117.00 -118.50 -117.21 -117.43 0.37 19 0 "[ . 1 . 2]"
177 PSI 2 58 PHE N 2 58 PHE CA 2 58 PHE C 2 59 ILE N 135.00 163.00 149.40 143.17 158.66 . . 0 "[ . 1 . 2]"
178 PHI 2 58 PHE C 2 59 ILE N 2 59 ILE CA 2 59 ILE C -133.00 -109.00 -119.54 -128.85 -114.03 . . 0 "[ . 1 . 2]"
179 PSI 2 59 ILE N 2 59 ILE CA 2 59 ILE C 2 60 SER N 120.00 140.00 118.27 117.14 119.86 2.86 19 0 "[ . 1 . 2]"
180 PHI 2 59 ILE C 2 60 SER N 2 60 SER CA 2 60 SER C -121.00 -69.00 -86.98 -98.12 -80.37 . . 0 "[ . 1 . 2]"
181 PSI 2 60 SER N 2 60 SER CA 2 60 SER C 2 61 LYS N 124.00 154.00 147.60 149.54 147.18 0.64 12 0 "[ . 1 . 2]"
182 PHI 2 60 SER C 2 61 LYS N 2 61 LYS CA 2 61 LYS C -76.00 -52.00 -76.04 -76.97 -77.08 1.17 1 0 "[ . 1 . 2]"
183 PHI 2 63 THR C 2 64 SER N 2 64 SER CA 2 64 SER C -91.00 -71.00 -87.97 -87.07 -87.61 0.07 10 0 "[ . 1 . 2]"
184 PSI 2 64 SER N 2 64 SER CA 2 64 SER C 2 65 ASP N 155.00 175.00 156.02 153.89 163.74 1.11 18 0 "[ . 1 . 2]"
185 PHI 2 64 SER C 2 65 ASP N 2 65 ASP CA 2 65 ASP C -70.00 -50.00 -62.89 -70.16 -49.70 0.30 12 0 "[ . 1 . 2]"
186 PSI 2 65 ASP N 2 65 ASP CA 2 65 ASP C 2 66 ALA N -46.00 -26.00 -32.78 -43.24 -25.36 0.64 19 0 "[ . 1 . 2]"
187 PHI 2 65 ASP C 2 66 ALA N 2 66 ALA CA 2 66 ALA C -73.00 -53.00 -61.19 -62.16 -63.44 . . 0 "[ . 1 . 2]"
188 PSI 2 66 ALA N 2 66 ALA CA 2 66 ALA C 2 67 GLN N -49.00 -29.00 -38.66 -49.13 -29.98 0.13 20 0 "[ . 1 . 2]"
189 PHI 2 66 ALA C 2 67 GLN N 2 67 GLN CA 2 67 GLN C -76.00 -56.00 -77.05 -78.00 -75.43 2.00 18 0 "[ . 1 . 2]"
190 PSI 2 67 GLN N 2 67 GLN CA 2 67 GLN C 2 68 LEU N -52.00 -32.00 -47.69 -49.43 -52.48 2.05 10 0 "[ . 1 . 2]"
191 PHI 2 67 GLN C 2 68 LEU N 2 68 LEU CA 2 68 LEU C -71.00 -51.00 -56.40 -59.12 -63.08 0.94 13 0 "[ . 1 . 2]"
192 PSI 2 68 LEU N 2 68 LEU CA 2 68 LEU C 2 69 LYS N -57.00 -37.00 -43.54 -52.34 -34.41 2.59 1 0 "[ . 1 . 2]"
193 PHI 2 68 LEU C 2 69 LYS N 2 69 LYS CA 2 69 LYS C -73.00 -53.00 -56.89 -62.36 -52.66 0.34 11 0 "[ . 1 . 2]"
194 PSI 2 69 LYS N 2 69 LYS CA 2 69 LYS C 2 70 ALA N -53.00 -33.00 -38.94 -36.27 -37.43 0.53 8 0 "[ . 1 . 2]"
195 PHI 2 69 LYS C 2 70 ALA N 2 70 ALA CA 2 70 ALA C -75.00 -55.00 -71.82 -74.54 -75.28 0.83 19 0 "[ . 1 . 2]"
196 PSI 2 70 ALA N 2 70 ALA CA 2 70 ALA C 2 71 MET N -50.00 -30.00 -34.71 -40.99 -29.06 0.94 1 0 "[ . 1 . 2]"
197 PHI 2 70 ALA C 2 71 MET N 2 71 MET CA 2 71 MET C -77.00 -57.00 -72.06 -71.12 -72.15 0.05 8 0 "[ . 1 . 2]"
198 PSI 2 71 MET N 2 71 MET CA 2 71 MET C 2 72 LYS N -47.00 -27.00 -40.93 -35.38 -37.00 0.12 5 0 "[ . 1 . 2]"
199 PHI 2 71 MET C 2 72 LYS N 2 72 LYS CA 2 72 LYS C -72.00 -52.00 -63.10 -64.01 -66.24 . . 0 "[ . 1 . 2]"
200 PSI 2 72 LYS N 2 72 LYS CA 2 72 LYS C 2 73 GLU N -54.00 -34.00 -38.39 -49.90 -32.11 1.89 13 0 "[ . 1 . 2]"
201 PHI 2 72 LYS C 2 73 GLU N 2 73 GLU CA 2 73 GLU C -74.00 -54.00 -63.25 -62.51 -63.34 . . 0 "[ . 1 . 2]"
202 PSI 2 73 GLU N 2 73 GLU CA 2 73 GLU C 2 74 TYR N -50.00 -30.00 -34.86 -44.65 -29.08 0.92 6 0 "[ . 1 . 2]"
203 PHI 2 73 GLU C 2 74 TYR N 2 74 TYR CA 2 74 TYR C -73.00 -53.00 -63.56 -69.17 -55.67 . . 0 "[ . 1 . 2]"
204 PSI 2 74 TYR N 2 74 TYR CA 2 74 TYR C 2 75 LEU N -54.00 -34.00 -48.41 -53.55 -43.28 . . 0 "[ . 1 . 2]"
205 PHI 2 74 TYR C 2 75 LEU N 2 75 LEU CA 2 75 LEU C -72.00 -52.00 -63.95 -68.08 -60.05 . . 0 "[ . 1 . 2]"
206 PSI 2 75 LEU N 2 75 LEU CA 2 75 LEU C 2 76 ASP N -51.00 -31.00 -33.53 -32.29 -32.60 0.68 16 0 "[ . 1 . 2]"
207 PHI 2 75 LEU C 2 76 ASP N 2 76 ASP CA 2 76 ASP C -75.00 -55.00 -67.89 -74.10 -61.58 . . 0 "[ . 1 . 2]"
208 PSI 2 76 ASP N 2 76 ASP CA 2 76 ASP C 2 77 ARG N -48.00 -28.00 -33.10 -31.91 -33.81 0.23 18 0 "[ . 1 . 2]"
209 PHI 2 76 ASP C 2 77 ARG N 2 77 ARG CA 2 77 ARG C -76.00 -56.00 -71.05 -76.27 -63.20 0.27 2 0 "[ . 1 . 2]"
210 PSI 2 77 ARG N 2 77 ARG CA 2 77 ARG C 2 78 LYS N -47.00 -25.00 -29.85 -30.99 -31.76 1.61 6 0 "[ . 1 . 2]"
211 PHI 2 77 ARG C 2 78 LYS N 2 78 LYS CA 2 78 LYS C -103.00 -81.00 -85.98 -82.97 -84.05 0.72 14 0 "[ . 1 . 2]"
212 PSI 2 78 LYS N 2 78 LYS CA 2 78 LYS C 2 79 GLY N -6.00 22.00 -8.48 -10.16 -5.95 4.16 3 0 "[ . 1 . 2]"
213 PHI 2 78 LYS C 2 79 GLY N 2 79 GLY CA 2 79 GLY C 68.00 92.00 68.29 66.78 72.98 1.22 11 0 "[ . 1 . 2]"
214 PSI 2 79 GLY N 2 79 GLY CA 2 79 GLY C 2 80 TRP N -8.00 30.00 24.49 14.10 30.85 0.85 12 0 "[ . 1 . 2]"
215 PHI 2 79 GLY C 2 80 TRP N 2 80 TRP CA 2 80 TRP C -136.00 -82.00 -89.72 -95.93 -96.60 1.00 13 0 "[ . 1 . 2]"
216 PSI 2 80 TRP N 2 80 TRP CA 2 80 TRP C 2 81 TRP N 117.00 155.00 151.93 154.83 152.92 0.89 7 0 "[ . 1 . 2]"
217 PHI 2 82 TYR C 2 83 GLU N 2 83 GLU CA 2 83 GLU C -156.00 -130.00 -128.77 -128.48 -128.64 2.18 5 0 "[ . 1 . 2]"
218 PSI 2 83 GLU N 2 83 GLU CA 2 83 GLU C 2 84 VAL N 138.00 168.00 142.22 141.09 140.35 1.09 11 0 "[ . 1 . 2]"
219 PHI 2 83 GLU C 2 84 VAL N 2 84 VAL CA 2 84 VAL C -126.00 -92.00 -105.96 -119.65 -90.98 1.02 18 0 "[ . 1 . 2]"
220 PSI 2 84 VAL N 2 84 VAL CA 2 84 VAL C 2 85 LYS N 116.00 146.00 117.75 114.40 129.97 1.60 10 0 "[ . 1 . 2]"
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