NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
597936 |
2mz8   |
25476 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mz8
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 217
_TA_constraint_stats_list.Viol_count 1313
_TA_constraint_stats_list.Viol_total 17470.03
_TA_constraint_stats_list.Viol_max 4.81
_TA_constraint_stats_list.Viol_rms 0.55
_TA_constraint_stats_list.Viol_average_all_restraints 0.20
_TA_constraint_stats_list.Viol_average_violations_only 0.67
_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 22 MET C 1 23 THR N 1 23 THR CA 1 23 THR C -136.70 -76.60 -96.62 -136.91 -75.70 0.90 4 0 "[ . 1 . 2]"
2 PSI 1 23 THR N 1 23 THR CA 1 23 THR C 1 24 LEU N 107.50 159.70 159.20 159.27 156.75 1.38 11 0 "[ . 1 . 2]"
3 PHI 1 23 THR C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -95.30 -64.30 -69.07 -75.74 -96.34 1.09 6 0 "[ . 1 . 2]"
4 PSI 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 PRO N 146.90 167.20 154.67 153.52 161.09 . . 0 "[ . 1 . 2]"
5 PSI 1 25 PRO N 1 25 PRO CA 1 25 PRO C 1 26 SER N -39.30 -17.30 -18.72 -26.26 -14.54 2.76 1 0 "[ . 1 . 2]"
6 PHI 1 25 PRO C 1 26 SER N 1 26 SER CA 1 26 SER C -92.10 -63.50 -75.02 -80.36 -61.58 1.92 1 0 "[ . 1 . 2]"
7 PSI 1 26 SER N 1 26 SER CA 1 26 SER C 1 27 GLY N -23.70 6.90 -19.00 -20.99 -24.00 0.30 1 0 "[ . 1 . 2]"
8 PHI 1 26 SER C 1 27 GLY N 1 27 GLY CA 1 27 GLY C 77.50 109.20 109.39 109.29 109.25 0.49 18 0 "[ . 1 . 2]"
9 PSI 1 27 GLY N 1 27 GLY CA 1 27 GLY C 1 28 HIS N -25.60 21.70 -2.21 -1.44 -4.80 0.21 1 0 "[ . 1 . 2]"
10 PHI 1 27 GLY C 1 28 HIS N 1 28 HIS CA 1 28 HIS C -94.40 -53.80 -91.47 -95.12 -73.54 0.72 5 0 "[ . 1 . 2]"
11 PSI 1 28 HIS N 1 28 HIS CA 1 28 HIS C 1 29 PRO N 117.60 165.00 148.95 138.00 153.64 . . 0 "[ . 1 . 2]"
12 PSI 1 29 PRO N 1 29 PRO CA 1 29 PRO C 1 30 LYS N 125.50 157.10 125.10 123.61 130.42 1.89 13 0 "[ . 1 . 2]"
13 PHI 1 29 PRO C 1 30 LYS N 1 30 LYS CA 1 30 LYS C -68.80 -47.80 -69.77 -71.57 -63.40 2.77 13 0 "[ . 1 . 2]"
14 PSI 1 30 LYS N 1 30 LYS CA 1 30 LYS C 1 31 SER N -57.20 -24.50 -47.04 -57.19 -24.32 0.18 1 0 "[ . 1 . 2]"
15 PHI 1 30 LYS C 1 31 SER N 1 31 SER CA 1 31 SER C -73.80 -54.80 -57.79 -57.86 -61.47 0.89 12 0 "[ . 1 . 2]"
16 PSI 1 31 SER N 1 31 SER CA 1 31 SER C 1 32 ARG N -46.90 -21.60 -41.59 -36.69 -39.17 0.23 4 0 "[ . 1 . 2]"
17 PHI 1 31 SER C 1 32 ARG N 1 32 ARG CA 1 32 ARG C -77.90 -62.30 -66.33 -70.77 -77.43 1.03 13 0 "[ . 1 . 2]"
18 PSI 1 32 ARG N 1 32 ARG CA 1 32 ARG C 1 33 LEU N -48.90 -25.50 -41.36 -49.15 -32.04 0.25 11 0 "[ . 1 . 2]"
19 PHI 1 32 ARG C 1 33 LEU N 1 33 LEU CA 1 33 LEU C -73.50 -58.60 -64.10 -73.72 -58.01 0.59 20 0 "[ . 1 . 2]"
20 PSI 1 33 LEU N 1 33 LEU CA 1 33 LEU C 1 34 ILE N -48.80 -32.30 -46.40 -49.12 -49.29 0.58 1 0 "[ . 1 . 2]"
21 PHI 1 33 LEU C 1 34 ILE N 1 34 ILE CA 1 34 ILE C -70.30 -55.40 -58.66 -57.37 -58.78 0.56 6 0 "[ . 1 . 2]"
22 PSI 1 34 ILE N 1 34 ILE CA 1 34 ILE C 1 35 LYS N -48.50 -31.70 -45.14 -48.97 -33.10 0.47 13 0 "[ . 1 . 2]"
23 PHI 1 34 ILE C 1 35 LYS N 1 35 LYS CA 1 35 LYS C -67.80 -59.70 -66.77 -68.80 -61.68 1.00 11 0 "[ . 1 . 2]"
24 PSI 1 35 LYS N 1 35 LYS CA 1 35 LYS C 1 36 LYS N -48.90 -34.30 -38.63 -49.40 -33.69 0.61 16 0 "[ . 1 . 2]"
25 PHI 1 35 LYS C 1 36 LYS N 1 36 LYS CA 1 36 LYS C -72.70 -57.80 -66.84 -57.59 -62.51 0.27 4 0 "[ . 1 . 2]"
26 PSI 1 36 LYS N 1 36 LYS CA 1 36 LYS C 1 37 PHE N -54.40 -27.60 -49.41 -53.45 -42.08 . . 0 "[ . 1 . 2]"
27 PHI 1 36 LYS C 1 37 PHE N 1 37 PHE CA 1 37 PHE C -77.00 -59.10 -59.56 -59.01 -59.05 0.56 12 0 "[ . 1 . 2]"
28 PSI 1 37 PHE N 1 37 PHE CA 1 37 PHE C 1 38 THR N -49.00 -21.50 -27.17 -33.36 -21.31 0.19 11 0 "[ . 1 . 2]"
29 PHI 1 37 PHE C 1 38 THR N 1 38 THR CA 1 38 THR C -74.80 -55.50 -62.84 -63.91 -65.06 0.11 11 0 "[ . 1 . 2]"
30 PSI 1 38 THR N 1 38 THR CA 1 38 THR C 1 39 ALA N -49.90 -23.20 -21.69 -21.25 -21.35 2.05 2 0 "[ . 1 . 2]"
31 PHI 1 38 THR C 1 39 ALA N 1 39 ALA CA 1 39 ALA C -79.60 -59.00 -79.56 -77.06 -78.61 1.35 13 0 "[ . 1 . 2]"
32 PSI 1 39 ALA N 1 39 ALA CA 1 39 ALA C 1 40 LEU N -45.60 -8.40 -7.69 -8.92 -6.85 1.55 7 0 "[ . 1 . 2]"
33 PHI 1 39 ALA C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -104.10 -58.70 -104.27 -105.36 -102.17 1.26 2 0 "[ . 1 . 2]"
34 PSI 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 GLY N -52.90 3.80 3.68 -5.27 4.46 0.66 20 0 "[ . 1 . 2]"
35 PHI 1 40 LEU C 1 41 GLY N 1 41 GLY CA 1 41 GLY C 56.00 175.30 167.23 162.99 175.46 0.16 15 0 "[ . 1 . 2]"
36 PSI 1 41 GLY N 1 41 GLY CA 1 41 GLY C 1 42 PRO N 155.50 -146.10 -150.51 -145.99 -148.05 0.40 18 0 "[ . 1 . 2]"
37 PSI 1 42 PRO N 1 42 PRO CA 1 42 PRO C 1 43 TYR N 108.20 167.00 168.58 165.09 169.42 2.42 16 0 "[ . 1 . 2]"
38 PHI 1 42 PRO C 1 43 TYR N 1 43 TYR CA 1 43 TYR C -170.00 -63.80 -62.04 -63.45 -61.12 2.68 16 0 "[ . 1 . 2]"
39 PSI 1 43 TYR N 1 43 TYR CA 1 43 TYR C 1 44 ILE N 109.10 179.40 130.43 127.02 125.59 . . 0 "[ . 1 . 2]"
40 PHI 1 43 TYR C 1 44 ILE N 1 44 ILE CA 1 44 ILE C -126.30 -50.30 -78.50 -97.19 -67.32 . . 0 "[ . 1 . 2]"
41 PSI 1 44 ILE N 1 44 ILE CA 1 44 ILE C 1 45 ARG N 112.00 146.70 141.55 134.76 145.12 . . 0 "[ . 1 . 2]"
42 PHI 1 44 ILE C 1 45 ARG N 1 45 ARG CA 1 45 ARG C -123.60 -71.10 -80.81 -77.96 -80.39 . . 0 "[ . 1 . 2]"
43 PSI 1 45 ARG N 1 45 ARG CA 1 45 ARG C 1 46 GLU N 93.90 167.90 100.85 93.50 93.34 0.56 1 0 "[ . 1 . 2]"
44 PHI 1 52 ASN C 1 53 ARG N 1 53 ARG CA 1 53 ARG C -142.80 -98.10 -115.42 -125.22 -129.76 0.05 20 0 "[ . 1 . 2]"
45 PSI 1 53 ARG N 1 53 ARG CA 1 53 ARG C 1 54 PHE N 122.80 161.10 156.78 160.17 157.91 . . 0 "[ . 1 . 2]"
46 PHI 1 53 ARG C 1 54 PHE N 1 54 PHE CA 1 54 PHE C -141.90 -57.40 -92.18 -79.74 -93.71 0.08 20 0 "[ . 1 . 2]"
47 PSI 1 54 PHE N 1 54 PHE CA 1 54 PHE C 1 55 PHE N 111.20 156.50 135.38 129.33 123.24 0.46 17 0 "[ . 1 . 2]"
48 PHI 1 54 PHE C 1 55 PHE N 1 55 PHE CA 1 55 PHE C -143.90 -93.30 -112.08 -102.86 -112.13 0.23 20 0 "[ . 1 . 2]"
49 PSI 1 55 PHE N 1 55 PHE CA 1 55 PHE C 1 56 PHE N 113.70 149.30 136.70 113.85 149.36 0.06 6 0 "[ . 1 . 2]"
50 PHI 1 55 PHE C 1 56 PHE N 1 56 PHE CA 1 56 PHE C -159.40 -92.40 -133.78 -115.03 -118.06 . . 0 "[ . 1 . 2]"
51 PSI 1 56 PHE N 1 56 PHE CA 1 56 PHE C 1 57 ASP N 116.60 170.40 132.54 116.35 156.15 0.25 3 0 "[ . 1 . 2]"
52 PHI 1 56 PHE C 1 57 ASP N 1 57 ASP CA 1 57 ASP C -106.70 -47.20 -106.44 -106.91 -106.95 1.08 16 0 "[ . 1 . 2]"
53 PSI 1 57 ASP N 1 57 ASP CA 1 57 ASP C 1 58 CYS N 112.90 155.30 112.29 109.01 113.46 3.89 16 0 "[ . 1 . 2]"
54 PHI 1 57 ASP C 1 58 CYS N 1 58 CYS CA 1 58 CYS C -106.30 -46.70 -105.64 -106.18 -106.35 3.83 16 0 "[ . 1 . 2]"
55 PSI 1 58 CYS N 1 58 CYS CA 1 58 CYS C 1 59 LEU N 83.10 160.00 122.12 82.71 160.46 0.46 13 0 "[ . 1 . 2]"
56 PHI 1 58 CYS C 1 59 LEU N 1 59 LEU CA 1 59 LEU C -110.80 -56.00 -103.12 -110.70 -110.89 0.83 16 0 "[ . 1 . 2]"
57 PSI 1 59 LEU N 1 59 LEU CA 1 59 LEU C 1 60 ALA N 89.80 147.70 107.68 89.49 134.74 0.31 16 0 "[ . 1 . 2]"
58 PHI 1 60 ALA C 1 61 VAL N 1 61 VAL CA 1 61 VAL C -160.90 -114.30 -141.00 -138.09 -140.66 . . 0 "[ . 1 . 2]"
59 PSI 1 61 VAL N 1 61 VAL CA 1 61 VAL C 1 62 CYS N 121.80 171.50 146.85 148.52 146.70 . . 0 "[ . 1 . 2]"
60 PHI 1 61 VAL C 1 62 CYS N 1 62 CYS CA 1 62 CYS C -90.70 -55.50 -82.54 -90.83 -67.64 0.13 6 0 "[ . 1 . 2]"
61 PSI 1 62 CYS N 1 62 CYS CA 1 62 CYS C 1 63 VAL N 97.80 156.60 136.03 149.68 147.99 0.05 17 0 "[ . 1 . 2]"
62 PHI 1 62 CYS C 1 63 VAL N 1 63 VAL CA 1 63 VAL C -81.30 -52.70 -71.14 -81.92 -53.28 0.62 10 0 "[ . 1 . 2]"
63 PSI 1 63 VAL N 1 63 VAL CA 1 63 VAL C 1 64 ASN N -53.00 -6.20 -34.52 -39.64 -45.44 1.61 14 0 "[ . 1 . 2]"
64 PHI 1 65 VAL C 1 66 LYS N 1 66 LYS CA 1 66 LYS C -75.70 -43.40 -59.91 -51.56 -52.50 . . 0 "[ . 1 . 2]"
65 PSI 1 66 LYS N 1 66 LYS CA 1 66 LYS C 1 67 PRO N -54.80 -30.50 -57.63 -58.31 -58.36 4.47 8 0 "[ . 1 . 2]"
66 PHI 1 67 PRO C 1 68 ALA N 1 68 ALA CA 1 68 ALA C -82.40 -49.50 -58.20 -58.43 -64.32 . . 0 "[ . 1 . 2]"
67 PSI 1 68 ALA N 1 68 ALA CA 1 68 ALA C 1 69 PRO N 117.80 159.70 159.85 160.01 159.97 0.60 14 0 "[ . 1 . 2]"
68 PSI 1 69 PRO N 1 69 PRO CA 1 69 PRO C 1 70 GLU N -48.60 -24.00 -30.01 -36.48 -48.24 1.84 13 0 "[ . 1 . 2]"
69 PHI 1 69 PRO C 1 70 GLU N 1 70 GLU CA 1 70 GLU C -79.90 -63.70 -68.58 -64.13 -68.05 2.02 13 0 "[ . 1 . 2]"
70 PSI 1 70 GLU N 1 70 GLU CA 1 70 GLU C 1 71 LYS N -25.60 0.10 -20.65 -25.91 -1.44 0.31 5 0 "[ . 1 . 2]"
71 PHI 1 70 GLU C 1 71 LYS N 1 71 LYS CA 1 71 LYS C -118.40 -84.10 -105.90 -118.57 -84.02 0.17 18 0 "[ . 1 . 2]"
72 PSI 1 71 LYS N 1 71 LYS CA 1 71 LYS C 1 72 ARG N -13.90 16.90 10.34 16.94 1.15 1.26 13 0 "[ . 1 . 2]"
73 PHI 1 71 LYS C 1 72 ARG N 1 72 ARG CA 1 72 ARG C -121.30 -37.30 -78.89 -91.53 -110.73 0.27 17 0 "[ . 1 . 2]"
74 PSI 1 72 ARG N 1 72 ARG CA 1 72 ARG C 1 73 GLU N 118.40 159.60 145.44 117.61 159.95 0.79 14 0 "[ . 1 . 2]"
75 PHI 1 72 ARG C 1 73 GLU N 1 73 GLU CA 1 73 GLU C -137.00 -58.00 -122.52 -137.93 -86.38 0.93 14 0 "[ . 1 . 2]"
76 PSI 1 73 GLU N 1 73 GLU CA 1 73 GLU C 1 74 PHE N 112.60 166.90 155.08 126.78 167.62 0.72 14 0 "[ . 1 . 2]"
77 PHI 1 73 GLU C 1 74 PHE N 1 74 PHE CA 1 74 PHE C -144.00 -111.80 -128.25 -144.17 -112.99 0.17 5 0 "[ . 1 . 2]"
78 PSI 1 74 PHE N 1 74 PHE CA 1 74 PHE C 1 75 TRP N 122.10 167.10 153.15 140.17 167.39 0.29 17 0 "[ . 1 . 2]"
79 PHI 1 74 PHE C 1 75 TRP N 1 75 TRP CA 1 75 TRP C -145.40 -81.10 -83.97 -82.06 -87.62 0.68 16 0 "[ . 1 . 2]"
80 PSI 1 75 TRP N 1 75 TRP CA 1 75 TRP C 1 76 GLY N 111.20 159.70 145.83 149.89 146.33 0.20 20 0 "[ . 1 . 2]"
81 PHI 1 78 TRP C 1 79 MET N 1 79 MET CA 1 79 MET C -145.60 -88.50 -122.01 -145.80 -92.36 0.20 3 0 "[ . 1 . 2]"
82 PSI 1 79 MET N 1 79 MET CA 1 79 MET C 1 80 GLU N 112.90 154.10 114.09 115.38 112.96 1.50 20 0 "[ . 1 . 2]"
83 PHI 1 79 MET C 1 80 GLU N 1 80 GLU CA 1 80 GLU C -113.20 -84.90 -111.84 -115.28 -101.92 2.08 20 0 "[ . 1 . 2]"
84 PSI 1 80 GLU N 1 80 GLU CA 1 80 GLU C 1 81 LEU N 113.60 142.80 116.59 116.52 114.04 1.25 3 0 "[ . 1 . 2]"
85 PHI 1 80 GLU C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -134.30 -112.40 -129.21 -136.45 -117.34 2.15 20 0 "[ . 1 . 2]"
86 PSI 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 GLU N 127.00 159.40 157.47 158.66 156.60 0.66 3 0 "[ . 1 . 2]"
87 PHI 1 81 LEU C 1 82 GLU N 1 82 GLU CA 1 82 GLU C -137.70 -104.70 -132.35 -138.02 -122.36 0.32 6 0 "[ . 1 . 2]"
88 PSI 1 82 GLU N 1 82 GLU CA 1 82 GLU C 1 83 ALA N 111.60 154.80 113.22 114.97 112.46 0.93 14 0 "[ . 1 . 2]"
89 PHI 1 82 GLU C 1 83 ALA N 1 83 ALA CA 1 83 ALA C -123.00 -39.60 -54.45 -57.91 -61.14 . . 0 "[ . 1 . 2]"
90 PSI 1 83 ALA N 1 83 ALA CA 1 83 ALA C 1 84 GLN N 96.60 167.30 122.93 134.21 126.37 . . 0 "[ . 1 . 2]"
91 PHI 1 83 ALA C 1 84 GLN N 1 84 GLN CA 1 84 GLN C -140.10 -77.70 -87.78 -111.26 -77.16 0.54 15 0 "[ . 1 . 2]"
92 PSI 1 84 GLN N 1 84 GLN CA 1 84 GLN C 1 85 GLU N 106.30 -152.90 -177.21 169.41 -169.40 . . 0 "[ . 1 . 2]"
93 PHI 1 84 GLN C 1 85 GLU N 1 85 GLU CA 1 85 GLU C -75.30 -47.20 -52.21 -52.04 -52.52 . . 0 "[ . 1 . 2]"
94 PSI 1 85 GLU N 1 85 GLU CA 1 85 GLU C 1 86 LYS N -64.60 -14.80 -56.32 -59.77 -63.24 0.13 1 0 "[ . 1 . 2]"
95 PHI 1 85 GLU C 1 86 LYS N 1 86 LYS CA 1 86 LYS C -147.20 -89.90 -139.52 -147.50 -126.73 0.30 16 0 "[ . 1 . 2]"
96 PSI 1 86 LYS N 1 86 LYS CA 1 86 LYS C 1 87 ARG N -44.00 40.60 29.79 8.48 41.72 1.12 20 0 "[ . 1 . 2]"
97 PHI 1 86 LYS C 1 87 ARG N 1 87 ARG CA 1 87 ARG C -175.20 -105.70 -150.63 -122.11 -134.78 . . 0 "[ . 1 . 2]"
98 PSI 1 87 ARG N 1 87 ARG CA 1 87 ARG C 1 88 PHE N 122.40 -179.60 174.66 176.95 174.52 0.22 3 0 "[ . 1 . 2]"
99 PHI 1 87 ARG C 1 88 PHE N 1 88 PHE CA 1 88 PHE C -153.00 -102.80 -134.23 -147.97 -120.37 . . 0 "[ . 1 . 2]"
100 PSI 1 88 PHE N 1 88 PHE CA 1 88 PHE C 1 89 THR N 113.60 167.20 146.62 126.85 166.40 . . 0 "[ . 1 . 2]"
101 PHI 1 88 PHE C 1 89 THR N 1 89 THR CA 1 89 THR C -141.30 -93.40 -129.76 -111.01 -121.93 0.39 19 0 "[ . 1 . 2]"
102 PSI 1 89 THR N 1 89 THR CA 1 89 THR C 1 90 TYR N 129.10 164.10 154.28 154.08 146.58 0.60 8 0 "[ . 1 . 2]"
103 PHI 1 89 THR C 1 90 TYR N 1 90 TYR CA 1 90 TYR C -158.40 -124.90 -145.30 -158.51 -124.63 0.27 1 0 "[ . 1 . 2]"
104 PSI 1 90 TYR N 1 90 TYR CA 1 90 TYR C 1 91 ARG N 143.50 172.40 158.20 143.31 172.65 0.25 7 0 "[ . 1 . 2]"
105 PHI 1 90 TYR C 1 91 ARG N 1 91 ARG CA 1 91 ARG C -154.00 -103.80 -140.87 -153.98 -119.47 . . 0 "[ . 1 . 2]"
106 PSI 1 91 ARG N 1 91 ARG CA 1 91 ARG C 1 92 TYR N 110.30 160.60 155.24 127.50 160.87 0.27 9 0 "[ . 1 . 2]"
107 PHI 1 91 ARG C 1 92 TYR N 1 92 TYR CA 1 92 TYR C -133.30 -84.70 -111.58 -133.06 -84.84 . . 0 "[ . 1 . 2]"
108 PSI 1 92 TYR N 1 92 TYR CA 1 92 TYR C 1 93 GLN N 104.20 156.80 115.82 133.63 123.92 0.29 4 0 "[ . 1 . 2]"
109 PHI 1 92 TYR C 1 93 GLN N 1 93 GLN CA 1 93 GLN C -135.70 -73.50 -134.91 -135.76 -135.79 0.42 20 0 "[ . 1 . 2]"
110 PSI 1 93 GLN N 1 93 GLN CA 1 93 GLN C 1 94 PHE N 106.70 146.70 135.23 138.06 132.67 0.09 4 0 "[ . 1 . 2]"
111 PHI 1 93 GLN C 1 94 PHE N 1 94 PHE CA 1 94 PHE C -132.70 -92.00 -95.94 -92.08 -93.37 0.41 3 0 "[ . 1 . 2]"
112 PSI 1 94 PHE N 1 94 PHE CA 1 94 PHE C 1 95 GLY N 121.00 165.90 155.10 138.43 165.88 . . 0 "[ . 1 . 2]"
113 PHI 1 94 PHE C 1 95 GLY N 1 95 GLY CA 1 95 GLY C 152.70 -101.40 177.28 155.95 -132.24 . . 0 "[ . 1 . 2]"
114 PSI 1 95 GLY N 1 95 GLY CA 1 95 GLY C 1 96 LEU N 124.10 -134.50 -154.36 -136.82 -142.08 . . 0 "[ . 1 . 2]"
115 PHI 1 95 GLY C 1 96 LEU N 1 96 LEU CA 1 96 LEU C -145.30 -107.60 -135.58 -144.80 -145.18 0.29 16 0 "[ . 1 . 2]"
116 PSI 1 96 LEU N 1 96 LEU CA 1 96 LEU C 1 97 PHE N 116.50 145.80 143.59 129.78 146.07 0.27 17 0 "[ . 1 . 2]"
117 PHI 1 96 LEU C 1 97 PHE N 1 97 PHE CA 1 97 PHE C -121.60 -71.60 -106.23 -121.81 -94.67 0.21 19 0 "[ . 1 . 2]"
118 PSI 1 97 PHE N 1 97 PHE CA 1 97 PHE C 1 98 ASP N 95.20 147.60 107.37 96.45 95.40 . . 0 "[ . 1 . 2]"
119 PHI 1 97 PHE C 1 98 ASP N 1 98 ASP CA 1 98 ASP C -98.00 -72.10 -86.81 -97.98 -72.00 0.10 9 0 "[ . 1 . 2]"
120 PSI 1 98 ASP N 1 98 ASP CA 1 98 ASP C 1 99 LYS N 170.10 -175.90 176.97 169.98 -175.60 0.30 6 0 "[ . 1 . 2]"
121 PHI 1 98 ASP C 1 99 LYS N 1 99 LYS CA 1 99 LYS C -81.30 -58.00 -74.61 -80.65 -81.00 0.20 19 0 "[ . 1 . 2]"
122 PSI 1 99 LYS N 1 99 LYS CA 1 99 LYS C 1 100 GLU N -29.20 0.80 -25.56 -20.59 -22.85 0.83 12 0 "[ . 1 . 2]"
123 PHI 1 99 LYS C 1 100 GLU N 1 100 GLU CA 1 100 GLU C -105.60 -78.30 -87.78 -78.17 -78.19 0.88 16 0 "[ . 1 . 2]"
124 PSI 1 100 GLU N 1 100 GLU CA 1 100 GLU C 1 101 GLY N -9.60 18.60 -9.48 -9.67 -9.69 1.01 16 0 "[ . 1 . 2]"
125 PHI 1 100 GLU C 1 101 GLY N 1 101 GLY CA 1 101 GLY C 69.70 96.30 75.10 69.09 96.77 0.61 16 0 "[ . 1 . 2]"
126 PSI 1 101 GLY N 1 101 GLY CA 1 101 GLY C 1 102 ASN N -1.50 25.40 18.60 9.01 26.06 0.66 6 0 "[ . 1 . 2]"
127 PHI 1 101 GLY C 1 102 ASN N 1 102 ASN CA 1 102 ASN C -119.90 -70.20 -86.47 -103.23 -69.68 0.52 6 0 "[ . 1 . 2]"
128 PSI 1 102 ASN N 1 102 ASN CA 1 102 ASN C 1 103 TRP N 121.40 159.20 139.49 121.39 159.35 0.15 17 0 "[ . 1 . 2]"
129 PHI 1 102 ASN C 1 103 TRP N 1 103 TRP CA 1 103 TRP C -112.70 -47.90 -66.61 -63.06 -66.23 . . 0 "[ . 1 . 2]"
130 PSI 1 103 TRP N 1 103 TRP CA 1 103 TRP C 1 104 THR N 121.80 157.10 123.51 121.21 131.76 0.59 18 0 "[ . 1 . 2]"
131 PHI 1 103 TRP C 1 104 THR N 1 104 THR CA 1 104 THR C -145.60 -107.10 -143.30 -142.36 -144.93 0.58 6 0 "[ . 1 . 2]"
132 PSI 1 104 THR N 1 104 THR CA 1 104 THR C 1 105 VAL N 106.40 157.50 114.17 106.29 137.11 0.11 20 0 "[ . 1 . 2]"
133 PHI 1 104 THR C 1 105 VAL N 1 105 VAL CA 1 105 VAL C -97.80 -57.50 -79.26 -97.45 -97.71 0.20 9 0 "[ . 1 . 2]"
134 PSI 1 105 VAL N 1 105 VAL CA 1 105 VAL C 1 106 VAL N 114.40 147.60 119.60 114.28 131.40 0.12 12 0 "[ . 1 . 2]"
135 PHI 1 105 VAL C 1 106 VAL N 1 106 VAL CA 1 106 VAL C -148.20 -105.30 -140.85 -128.56 -129.97 0.24 8 0 "[ . 1 . 2]"
136 PSI 1 106 VAL N 1 106 VAL CA 1 106 VAL C 1 107 PRO N 98.10 167.60 146.22 158.02 157.88 . . 0 "[ . 1 . 2]"
137 PSI 1 107 PRO N 1 107 PRO CA 1 107 PRO C 1 108 ILE N 121.10 157.50 146.11 137.37 157.52 0.02 9 0 "[ . 1 . 2]"
138 PHI 1 107 PRO C 1 108 ILE N 1 108 ILE CA 1 108 ILE C -96.90 -56.20 -89.55 -97.63 -64.85 0.73 15 0 "[ . 1 . 2]"
139 PSI 1 108 ILE N 1 108 ILE CA 1 108 ILE C 1 109 ASN N 115.20 169.60 130.51 112.41 153.61 2.79 15 0 "[ . 1 . 2]"
140 PHI 1 108 ILE C 1 109 ASN N 1 109 ASN CA 1 109 ASN C -96.70 -51.00 -77.33 -99.07 -57.35 2.37 15 0 "[ . 1 . 2]"
141 PSI 1 109 ASN N 1 109 ASN CA 1 109 ASN C 1 110 GLU N 92.60 -174.50 165.35 155.42 152.88 2.61 15 0 "[ . 1 . 2]"
142 PHI 1 110 GLU C 1 111 THR N 1 111 THR CA 1 111 THR C -69.30 -45.80 -53.09 -53.80 -54.26 . . 0 "[ . 1 . 2]"
143 PSI 1 111 THR N 1 111 THR CA 1 111 THR C 1 112 GLU N -48.00 -28.20 -28.44 -31.85 -27.43 0.77 3 0 "[ . 1 . 2]"
144 PHI 1 111 THR C 1 112 GLU N 1 112 GLU CA 1 112 GLU C -76.20 -54.20 -54.50 -54.05 -54.17 1.30 14 0 "[ . 1 . 2]"
145 PSI 1 112 GLU N 1 112 GLU CA 1 112 GLU C 1 113 VAL N -41.60 -27.90 -38.75 -35.43 -35.98 1.32 17 0 "[ . 1 . 2]"
146 PHI 1 112 GLU C 1 113 VAL N 1 113 VAL CA 1 113 VAL C -77.90 -64.70 -79.57 -81.46 -78.48 3.56 19 0 "[ . 1 . 2]"
147 PSI 1 113 VAL N 1 113 VAL CA 1 113 VAL C 1 114 VAL N -52.00 -32.40 -43.56 -45.91 -46.08 0.54 19 0 "[ . 1 . 2]"
148 PHI 1 113 VAL C 1 114 VAL N 1 114 VAL CA 1 114 VAL C -71.70 -50.50 -56.07 -72.00 -51.06 0.30 20 0 "[ . 1 . 2]"
149 PSI 1 114 VAL N 1 114 VAL CA 1 114 VAL C 1 115 GLU N -50.30 -37.70 -33.47 -33.08 -33.11 4.81 10 0 "[ . 1 . 2]"
150 PHI 1 114 VAL C 1 115 GLU N 1 115 GLU CA 1 115 GLU C -69.90 -59.70 -65.51 -71.41 -60.26 1.51 20 0 "[ . 1 . 2]"
151 PSI 1 115 GLU N 1 115 GLU CA 1 115 GLU C 1 116 ARG N -47.90 -29.20 -34.12 -32.78 -33.79 1.92 18 0 "[ . 1 . 2]"
152 PHI 1 115 GLU C 1 116 ARG N 1 116 ARG CA 1 116 ARG C -74.40 -62.90 -70.34 -74.60 -62.88 0.20 11 0 "[ . 1 . 2]"
153 PSI 1 116 ARG N 1 116 ARG CA 1 116 ARG C 1 117 LEU N -46.60 -31.70 -39.06 -35.43 -35.97 0.25 17 0 "[ . 1 . 2]"
154 PHI 1 116 ARG C 1 117 LEU N 1 117 LEU CA 1 117 LEU C -70.70 -59.60 -69.29 -70.88 -62.48 0.18 4 0 "[ . 1 . 2]"
155 PSI 1 117 LEU N 1 117 LEU CA 1 117 LEU C 1 118 GLU N -50.80 -35.10 -37.34 -45.21 -34.70 0.40 13 0 "[ . 1 . 2]"
156 PHI 1 117 LEU C 1 118 GLU N 1 118 GLU CA 1 118 GLU C -68.80 -56.90 -63.34 -69.45 -56.51 0.65 5 0 "[ . 1 . 2]"
157 PSI 1 118 GLU N 1 118 GLU CA 1 118 GLU C 1 119 TYR N -48.80 -32.50 -39.47 -48.76 -32.69 . . 0 "[ . 1 . 2]"
158 PHI 1 118 GLU C 1 119 TYR N 1 119 TYR CA 1 119 TYR C -70.20 -55.00 -69.44 -65.93 -68.15 1.92 18 0 "[ . 1 . 2]"
159 PSI 1 119 TYR N 1 119 TYR CA 1 119 TYR C 1 120 THR N -50.80 -36.50 -41.17 -47.94 -50.40 2.69 12 0 "[ . 1 . 2]"
160 PHI 1 119 TYR C 1 120 THR N 1 120 THR CA 1 120 THR C -74.10 -60.40 -65.42 -61.29 -63.18 0.70 2 0 "[ . 1 . 2]"
161 PSI 1 120 THR N 1 120 THR CA 1 120 THR C 1 121 LEU N -45.80 -25.60 -39.03 -25.49 -27.64 1.30 18 0 "[ . 1 . 2]"
162 PHI 1 120 THR C 1 121 LEU N 1 121 LEU CA 1 121 LEU C -72.60 -57.90 -66.64 -74.79 -57.89 2.19 2 0 "[ . 1 . 2]"
163 PSI 1 121 LEU N 1 121 LEU CA 1 121 LEU C 1 122 ARG N -50.50 -36.10 -39.21 -40.72 -44.20 4.14 8 0 "[ . 1 . 2]"
164 PHI 1 121 LEU C 1 122 ARG N 1 122 ARG CA 1 122 ARG C -69.00 -55.70 -68.91 -72.80 -60.52 3.80 16 0 "[ . 1 . 2]"
165 PSI 1 122 ARG N 1 122 ARG CA 1 122 ARG C 1 123 GLU N -49.00 -34.90 -44.82 -49.78 -34.88 0.78 2 0 "[ . 1 . 2]"
166 PHI 1 122 ARG C 1 123 GLU N 1 123 GLU CA 1 123 GLU C -72.50 -57.10 -67.76 -73.12 -56.99 0.62 7 0 "[ . 1 . 2]"
167 PSI 1 123 GLU N 1 123 GLU CA 1 123 GLU C 1 124 PHE N -52.00 -29.50 -30.02 -38.17 -28.38 1.12 6 0 "[ . 1 . 2]"
168 PHI 1 123 GLU C 1 124 PHE N 1 124 PHE CA 1 124 PHE C -71.70 -58.40 -63.33 -72.79 -57.53 1.09 2 0 "[ . 1 . 2]"
169 PSI 1 124 PHE N 1 124 PHE CA 1 124 PHE C 1 125 HIS N -50.80 -35.30 -38.64 -36.24 -38.87 1.09 2 0 "[ . 1 . 2]"
170 PHI 1 124 PHE C 1 125 HIS N 1 125 HIS CA 1 125 HIS C -68.80 -53.90 -68.29 -69.45 -69.83 1.96 17 0 "[ . 1 . 2]"
171 PSI 1 125 HIS N 1 125 HIS CA 1 125 HIS C 1 126 GLU N -50.50 -33.40 -35.15 -46.41 -32.28 1.12 3 0 "[ . 1 . 2]"
172 PHI 1 125 HIS C 1 126 GLU N 1 126 GLU CA 1 126 GLU C -72.00 -56.80 -63.70 -72.58 -56.41 0.58 16 0 "[ . 1 . 2]"
173 PSI 1 126 GLU N 1 126 GLU CA 1 126 GLU C 1 127 LYS N -47.30 -31.90 -48.08 -48.11 -48.23 1.73 1 0 "[ . 1 . 2]"
174 PHI 1 126 GLU C 1 127 LYS N 1 127 LYS CA 1 127 LYS C -73.40 -59.80 -68.47 -72.20 -73.16 0.84 12 0 "[ . 1 . 2]"
175 PSI 1 127 LYS N 1 127 LYS CA 1 127 LYS C 1 128 LEU N -48.40 -34.20 -32.37 -32.28 -32.50 2.62 8 0 "[ . 1 . 2]"
176 PHI 1 127 LYS C 1 128 LEU N 1 128 LEU CA 1 128 LEU C -70.70 -59.00 -65.33 -63.70 -65.09 0.88 12 0 "[ . 1 . 2]"
177 PSI 1 128 LEU N 1 128 LEU CA 1 128 LEU C 1 129 ARG N -50.10 -35.70 -35.78 -38.68 -33.98 1.72 3 0 "[ . 1 . 2]"
178 PHI 1 128 LEU C 1 129 ARG N 1 129 ARG CA 1 129 ARG C -67.60 -54.70 -57.80 -62.72 -65.68 2.60 3 0 "[ . 1 . 2]"
179 PSI 1 129 ARG N 1 129 ARG CA 1 129 ARG C 1 130 ASP N -50.50 -29.70 -45.15 -43.40 -44.02 0.13 15 0 "[ . 1 . 2]"
180 PHI 1 129 ARG C 1 130 ASP N 1 130 ASP CA 1 130 ASP C -71.90 -56.50 -57.83 -66.10 -55.72 0.78 9 0 "[ . 1 . 2]"
181 PSI 1 130 ASP N 1 130 ASP CA 1 130 ASP C 1 131 LEU N -46.40 -34.10 -44.72 -46.42 -46.57 0.48 19 0 "[ . 1 . 2]"
182 PHI 1 130 ASP C 1 131 LEU N 1 131 LEU CA 1 131 LEU C -73.60 -58.80 -60.53 -58.99 -59.31 0.53 7 0 "[ . 1 . 2]"
183 PSI 1 131 LEU N 1 131 LEU CA 1 131 LEU C 1 132 LEU N -49.80 -34.50 -51.01 -50.06 -50.40 2.21 4 0 "[ . 1 . 2]"
184 PHI 1 131 LEU C 1 132 LEU N 1 132 LEU CA 1 132 LEU C -70.50 -60.00 -62.26 -64.24 -59.42 0.58 1 0 "[ . 1 . 2]"
185 PSI 1 132 LEU N 1 132 LEU CA 1 132 LEU C 1 133 ILE N -46.90 -32.90 -34.10 -41.28 -30.93 1.97 16 0 "[ . 1 . 2]"
186 PHI 1 132 LEU C 1 133 ILE N 1 133 ILE CA 1 133 ILE C -73.00 -60.90 -65.23 -63.28 -64.95 0.18 20 0 "[ . 1 . 2]"
187 PSI 1 133 ILE N 1 133 ILE CA 1 133 ILE C 1 134 SER N -47.60 -30.20 -32.84 -39.13 -29.80 0.40 11 0 "[ . 1 . 2]"
188 PHI 1 133 ILE C 1 134 SER N 1 134 SER CA 1 134 SER C -73.50 -60.20 -72.40 -74.56 -65.66 1.06 16 0 "[ . 1 . 2]"
189 PSI 1 134 SER N 1 134 SER CA 1 134 SER C 1 135 MET N -37.50 -15.20 -24.78 -26.40 -30.19 . . 0 "[ . 1 . 2]"
190 PHI 1 134 SER C 1 135 MET N 1 135 MET CA 1 135 MET C -108.40 -84.90 -99.18 -96.06 -96.26 0.53 16 0 "[ . 1 . 2]"
191 PSI 1 135 MET N 1 135 MET CA 1 135 MET C 1 136 GLU N -8.10 25.90 -2.91 -8.41 2.73 0.31 18 0 "[ . 1 . 2]"
192 PHI 1 135 MET C 1 136 GLU N 1 136 GLU CA 1 136 GLU C 46.60 68.00 63.07 63.70 63.56 . . 0 "[ . 1 . 2]"
193 PSI 1 136 GLU N 1 136 GLU CA 1 136 GLU C 1 137 LEU N 29.70 54.20 41.14 33.44 48.91 . . 0 "[ . 1 . 2]"
194 PHI 1 136 GLU C 1 137 LEU N 1 137 LEU CA 1 137 LEU C -126.00 -103.40 -104.32 -111.71 -102.06 1.34 16 0 "[ . 1 . 2]"
195 PSI 1 137 LEU N 1 137 LEU CA 1 137 LEU C 1 138 ALA N 114.10 176.10 139.72 135.55 133.10 0.21 11 0 "[ . 1 . 2]"
196 PHI 1 137 LEU C 1 138 ALA N 1 138 ALA CA 1 138 ALA C -159.40 -54.90 -79.86 -111.56 -59.32 . . 0 "[ . 1 . 2]"
197 PSI 1 138 ALA N 1 138 ALA CA 1 138 ALA C 1 139 LEU N 106.60 159.50 150.76 134.64 159.94 0.44 16 0 "[ . 1 . 2]"
198 PHI 1 138 ALA C 1 139 LEU N 1 139 LEU CA 1 139 LEU C -129.60 -83.50 -123.70 -129.91 -99.71 0.31 6 0 "[ . 1 . 2]"
199 PSI 1 139 LEU N 1 139 LEU CA 1 139 LEU C 1 140 GLU N 112.70 142.90 133.55 112.49 143.16 0.26 16 0 "[ . 1 . 2]"
200 PHI 1 139 LEU C 1 140 GLU N 1 140 GLU CA 1 140 GLU C -156.20 -118.20 -145.75 -156.24 -126.82 0.04 18 0 "[ . 1 . 2]"
201 PSI 1 140 GLU N 1 140 GLU CA 1 140 GLU C 1 141 PRO N 115.10 178.90 159.30 153.61 160.60 . . 0 "[ . 1 . 2]"
202 PSI 1 141 PRO N 1 141 PRO CA 1 141 PRO C 1 142 SER N 126.50 171.30 171.13 169.82 171.56 0.26 6 0 "[ . 1 . 2]"
203 PHI 1 142 SER C 1 143 ASP N 1 143 ASP CA 1 143 ASP C -81.00 -48.10 -65.56 -59.59 -61.77 0.04 10 0 "[ . 1 . 2]"
204 PSI 1 143 ASP N 1 143 ASP CA 1 143 ASP C 1 144 ASP N -52.00 1.10 -22.58 -33.63 -14.47 . . 0 "[ . 1 . 2]"
205 PHI 1 143 ASP C 1 144 ASP N 1 144 ASP CA 1 144 ASP C -111.70 -76.30 -96.28 -111.81 -76.27 0.11 20 0 "[ . 1 . 2]"
206 PSI 1 144 ASP N 1 144 ASP CA 1 144 ASP C 1 145 PHE N -9.20 26.40 20.43 13.89 -9.27 0.17 11 0 "[ . 1 . 2]"
207 PHI 1 144 ASP C 1 145 PHE N 1 145 PHE CA 1 145 PHE C -138.20 -91.10 -106.13 -94.81 -105.21 0.08 8 0 "[ . 1 . 2]"
208 PSI 1 145 PHE N 1 145 PHE CA 1 145 PHE C 1 146 ASN N 107.60 152.70 123.50 107.55 152.67 0.05 10 0 "[ . 1 . 2]"
209 PSI 1 149 PRO N 1 149 PRO CA 1 149 PRO C 1 150 VAL N 132.00 159.00 154.40 152.54 151.18 0.13 9 0 "[ . 1 . 2]"
210 PHI 1 149 PRO C 1 150 VAL N 1 150 VAL CA 1 150 VAL C -124.90 -53.90 -61.66 -53.86 -53.93 0.13 9 0 "[ . 1 . 2]"
211 PSI 1 150 VAL N 1 150 VAL CA 1 150 VAL C 1 151 LYS N 106.70 172.30 134.75 155.65 147.83 . . 0 "[ . 1 . 2]"
212 PHI 1 150 VAL C 1 151 LYS N 1 151 LYS CA 1 151 LYS C -96.30 -53.70 -79.01 -96.79 -64.34 0.49 20 0 "[ . 1 . 2]"
213 PSI 1 151 LYS N 1 151 LYS CA 1 151 LYS C 1 152 LEU N 97.50 177.00 98.27 98.02 97.84 0.97 20 0 "[ . 1 . 2]"
214 PHI 1 151 LYS C 1 152 LEU N 1 152 LEU CA 1 152 LEU C -73.60 -53.70 -71.33 -69.19 -72.61 0.71 20 0 "[ . 1 . 2]"
215 PSI 1 152 LEU N 1 152 LEU CA 1 152 LEU C 1 153 SER N -37.10 -16.70 -31.39 -36.60 -25.75 . . 0 "[ . 1 . 2]"
216 PHI 1 152 LEU C 1 153 SER N 1 153 SER CA 1 153 SER C -105.40 -73.60 -97.12 -92.45 -95.35 . . 0 "[ . 1 . 2]"
217 PSI 1 153 SER N 1 153 SER CA 1 153 SER C 1 154 ALA N -49.90 65.60 55.83 61.25 58.49 . . 0 "[ . 1 . 2]"
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