NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
575452 |
2mem   |
19526 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mem
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 174
_TA_constraint_stats_list.Viol_count 355
_TA_constraint_stats_list.Viol_total 12685.76
_TA_constraint_stats_list.Viol_max 8.02
_TA_constraint_stats_list.Viol_rms 0.71
_TA_constraint_stats_list.Viol_average_all_restraints 0.18
_TA_constraint_stats_list.Viol_average_violations_only 1.79
_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 6 SER C 1 7 THR N 1 7 THR CA 1 7 THR C -173.40 -85.00 -137.62 -140.08 -140.65 . . 0 "[ . 1 . 2]"
2 PSI 1 7 THR N 1 7 THR CA 1 7 THR C 1 8 VAL N 135.10 175.10 137.93 133.45 144.45 1.65 8 0 "[ . 1 . 2]"
3 PHI 1 7 THR C 1 8 VAL N 1 8 VAL CA 1 8 VAL C -167.10 -124.50 -140.10 -139.07 -140.03 . . 0 "[ . 1 . 2]"
4 PSI 1 8 VAL N 1 8 VAL CA 1 8 VAL C 1 9 CYS N 132.70 172.70 162.61 147.42 174.22 1.52 1 0 "[ . 1 . 2]"
5 PHI 1 8 VAL C 1 9 CYS N 1 9 CYS CA 1 9 CYS C -164.30 -75.20 -135.06 -137.57 -142.65 . . 0 "[ . 1 . 2]"
6 PSI 1 9 CYS N 1 9 CYS CA 1 9 CYS C 1 10 VAL N 109.30 149.30 110.78 101.59 132.36 7.71 18 1 "[ . 1 . + 2]"
7 PHI 1 9 CYS C 1 10 VAL N 1 10 VAL CA 1 10 VAL C -146.90 -78.00 -98.70 -96.67 -98.21 . . 0 "[ . 1 . 2]"
8 PSI 1 10 VAL N 1 10 VAL CA 1 10 VAL C 1 11 TYR N 103.30 167.50 150.52 158.41 154.58 . . 0 "[ . 1 . 2]"
9 PHI 1 10 VAL C 1 11 TYR N 1 11 TYR CA 1 11 TYR C -156.30 -54.70 -117.31 -130.18 -88.54 . . 0 "[ . 1 . 2]"
10 PSI 1 11 TYR N 1 11 TYR CA 1 11 TYR C 1 12 VAL N 100.20 170.20 101.56 106.33 104.33 2.26 8 0 "[ . 1 . 2]"
11 PHI 1 12 VAL C 1 13 ASN N 1 13 ASN CA 1 13 ASN C -109.80 -67.80 -92.04 -94.90 -96.16 . . 0 "[ . 1 . 2]"
12 PSI 1 13 ASN N 1 13 ASN CA 1 13 ASN C 1 14 LYS N 79.10 131.70 91.26 81.22 104.11 . . 0 "[ . 1 . 2]"
13 PHI 1 13 ASN C 1 14 LYS N 1 14 LYS CA 1 14 LYS C -96.30 -49.10 -73.58 -70.62 -72.50 . . 0 "[ . 1 . 2]"
14 PSI 1 14 LYS N 1 14 LYS CA 1 14 LYS C 1 15 HIS N -54.20 14.50 -12.05 -31.02 -3.60 . . 0 "[ . 1 . 2]"
15 PHI 1 14 LYS C 1 15 HIS N 1 15 HIS CA 1 15 HIS C -112.70 -61.40 -78.22 -90.89 -71.69 . . 0 "[ . 1 . 2]"
16 PSI 1 15 HIS N 1 15 HIS CA 1 15 HIS C 1 16 GLY N -27.20 27.60 -17.06 -16.45 -17.99 1.36 18 0 "[ . 1 . 2]"
17 PHI 1 17 ASN C 1 18 PHE N 1 18 PHE CA 1 18 PHE C -134.50 -74.00 -88.29 -109.22 -73.44 0.56 9 0 "[ . 1 . 2]"
18 PSI 1 18 PHE N 1 18 PHE CA 1 18 PHE C 1 19 GLY N -64.50 56.60 -60.04 -65.02 -52.69 0.52 2 0 "[ . 1 . 2]"
19 PHI 1 20 PRO C 1 21 HIS N 1 21 HIS CA 1 21 HIS C -121.00 -61.50 -74.76 -79.16 -82.69 0.21 14 0 "[ . 1 . 2]"
20 PSI 1 21 HIS N 1 21 HIS CA 1 21 HIS C 1 22 LEU N -68.40 5.10 -8.64 -22.69 0.94 . . 0 "[ . 1 . 2]"
21 PHI 1 21 HIS C 1 22 LEU N 1 22 LEU CA 1 22 LEU C 161.40 -63.30 -106.38 -114.78 -116.21 . . 0 "[ . 1 . 2]"
22 PSI 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 ASP N 102.20 -168.60 139.10 123.99 146.79 . . 0 "[ . 1 . 2]"
23 PHI 1 22 LEU C 1 23 ASP N 1 23 ASP CA 1 23 ASP C -128.30 -30.80 -67.63 -77.19 -55.01 . . 0 "[ . 1 . 2]"
24 PSI 1 23 ASP N 1 23 ASP CA 1 23 ASP C 1 24 PRO N 92.00 -178.10 122.25 129.29 127.49 . . 0 "[ . 1 . 2]"
25 PSI 1 24 PRO N 1 24 PRO CA 1 24 PRO C 1 25 LYS N -54.60 -14.60 -29.82 -41.49 -16.88 . . 0 "[ . 1 . 2]"
26 PHI 1 24 PRO C 1 25 LYS N 1 25 LYS CA 1 25 LYS C -82.90 -42.90 -76.82 -69.92 -72.78 1.84 11 0 "[ . 1 . 2]"
27 PSI 1 25 LYS N 1 25 LYS CA 1 25 LYS C 1 26 ARG N -54.00 -14.00 -45.37 -41.77 -42.55 . . 0 "[ . 1 . 2]"
28 PHI 1 25 LYS C 1 26 ARG N 1 26 ARG CA 1 26 ARG C -86.80 -46.80 -67.06 -74.11 -61.94 . . 0 "[ . 1 . 2]"
29 PSI 1 26 ARG N 1 26 ARG CA 1 26 ARG C 1 27 ILE N -63.00 -23.00 -32.37 -28.88 -29.78 . . 0 "[ . 1 . 2]"
30 PHI 1 26 ARG C 1 27 ILE N 1 27 ILE CA 1 27 ILE C -84.50 -44.50 -61.19 -66.63 -52.55 . . 0 "[ . 1 . 2]"
31 PSI 1 27 ILE N 1 27 ILE CA 1 27 ILE C 1 28 GLN N -57.20 -17.20 -29.72 -29.93 -30.24 . . 0 "[ . 1 . 2]"
32 PHI 1 27 ILE C 1 28 GLN N 1 28 GLN CA 1 28 GLN C -85.10 -40.90 -82.31 -81.67 -82.81 0.66 11 0 "[ . 1 . 2]"
33 PSI 1 28 GLN N 1 28 GLN CA 1 28 GLN C 1 29 GLN N -50.60 -6.50 -23.27 -35.92 -17.05 . . 0 "[ . 1 . 2]"
34 PHI 1 28 GLN C 1 29 GLN N 1 29 GLN CA 1 29 GLN C -122.00 -63.00 -79.59 -75.39 -77.60 . . 0 "[ . 1 . 2]"
35 PSI 1 29 GLN N 1 29 GLN CA 1 29 GLN C 1 30 LEU N -48.60 27.40 -31.38 -38.67 -41.54 . . 0 "[ . 1 . 2]"
36 PHI 1 29 GLN C 1 30 LEU N 1 30 LEU CA 1 30 LEU C -119.20 -25.10 -69.48 -74.82 -63.70 . . 0 "[ . 1 . 2]"
37 PSI 1 30 LEU N 1 30 LEU CA 1 30 LEU C 1 31 PRO N 92.10 173.20 157.70 153.27 172.23 . . 0 "[ . 1 . 2]"
38 PSI 1 31 PRO N 1 31 PRO CA 1 31 PRO C 1 32 ASP N 87.20 -146.50 159.54 148.62 169.75 . . 0 "[ . 1 . 2]"
39 PHI 1 31 PRO C 1 32 ASP N 1 32 ASP CA 1 32 ASP C -132.20 -28.40 -76.50 -86.41 -64.99 . . 0 "[ . 1 . 2]"
40 PSI 1 32 ASP N 1 32 ASP CA 1 32 ASP C 1 33 HIS N -81.70 27.20 -11.05 -14.00 -17.15 . . 0 "[ . 1 . 2]"
41 PHI 1 33 HIS C 1 34 PHE N 1 34 PHE CA 1 34 PHE C -158.00 -91.50 -120.94 -122.90 -124.76 . . 0 "[ . 1 . 2]"
42 PSI 1 34 PHE N 1 34 PHE CA 1 34 PHE C 1 35 GLY N 106.00 169.90 114.22 126.97 113.29 4.06 12 0 "[ . 1 . 2]"
43 PSI 1 36 PRO N 1 36 PRO CA 1 36 PRO C 1 37 GLY N 130.60 176.20 131.44 127.47 140.47 3.13 2 0 "[ . 1 . 2]"
44 PSI 1 38 PRO N 1 38 PRO CA 1 38 PRO C 1 39 VAL N 125.30 165.30 138.23 137.20 134.72 . . 0 "[ . 1 . 2]"
45 PHI 1 38 PRO C 1 39 VAL N 1 39 VAL CA 1 39 VAL C -74.00 -25.60 -47.43 -55.32 -38.01 . . 0 "[ . 1 . 2]"
46 PSI 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 40 ASN N -67.30 -21.70 -44.14 -46.57 -48.38 . . 0 "[ . 1 . 2]"
47 PHI 1 39 VAL C 1 40 ASN N 1 40 ASN CA 1 40 ASN C -80.90 -40.90 -66.18 -72.97 -75.74 . . 0 "[ . 1 . 2]"
48 PSI 1 40 ASN N 1 40 ASN CA 1 40 ASN C 1 41 VAL N -59.00 -19.00 -45.69 -59.33 -33.70 0.33 13 0 "[ . 1 . 2]"
49 PHI 1 40 ASN C 1 41 VAL N 1 41 VAL CA 1 41 VAL C -81.80 -41.80 -73.85 -75.33 -76.41 0.07 1 0 "[ . 1 . 2]"
50 PSI 1 41 VAL N 1 41 VAL CA 1 41 VAL C 1 42 VAL N -66.40 -26.40 -46.92 -57.67 -35.39 . . 0 "[ . 1 . 2]"
51 PHI 1 41 VAL C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -81.20 -41.20 -58.75 -64.40 -64.64 . . 0 "[ . 1 . 2]"
52 PSI 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 LEU N -63.20 -23.20 -40.15 -31.68 -36.63 . . 0 "[ . 1 . 2]"
53 PHI 1 42 VAL C 1 43 LEU N 1 43 LEU CA 1 43 LEU C -89.60 -40.00 -69.87 -75.76 -66.39 . . 0 "[ . 1 . 2]"
54 PSI 1 43 LEU N 1 43 LEU CA 1 43 LEU C 1 44 ARG N -61.40 -21.40 -41.51 -42.55 -43.43 . . 0 "[ . 1 . 2]"
55 PHI 1 43 LEU C 1 44 ARG N 1 44 ARG CA 1 44 ARG C -81.30 -41.30 -71.40 -74.91 -67.57 . . 0 "[ . 1 . 2]"
56 PSI 1 44 ARG N 1 44 ARG CA 1 44 ARG C 1 45 ARG N -66.00 -26.00 -28.26 -33.33 -33.84 1.53 7 0 "[ . 1 . 2]"
57 PHI 1 44 ARG C 1 45 ARG N 1 45 ARG CA 1 45 ARG C -78.60 -38.60 -66.87 -56.21 -63.07 . . 0 "[ . 1 . 2]"
58 PSI 1 45 ARG N 1 45 ARG CA 1 45 ARG C 1 46 ILE N -60.80 -20.80 -34.44 -43.32 -20.18 0.62 1 0 "[ . 1 . 2]"
59 PHI 1 45 ARG C 1 46 ILE N 1 46 ILE CA 1 46 ILE C -85.80 -45.80 -67.65 -73.42 -74.71 . . 0 "[ . 1 . 2]"
60 PSI 1 46 ILE N 1 46 ILE CA 1 46 ILE C 1 47 VAL N -65.80 -25.80 -53.77 -59.01 -47.67 . . 0 "[ . 1 . 2]"
61 PHI 1 46 ILE C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -80.20 -40.20 -60.28 -66.13 -55.76 . . 0 "[ . 1 . 2]"
62 PSI 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 GLN N -65.10 -25.10 -51.06 -53.84 -55.79 . . 0 "[ . 1 . 2]"
63 PHI 1 47 VAL C 1 48 GLN N 1 48 GLN CA 1 48 GLN C -79.30 -39.30 -67.57 -65.54 -67.50 0.28 14 0 "[ . 1 . 2]"
64 PSI 1 48 GLN N 1 48 GLN CA 1 48 GLN C 1 49 ALA N -62.60 -22.60 -30.50 -37.36 -21.81 0.79 17 0 "[ . 1 . 2]"
65 PHI 1 48 GLN C 1 49 ALA N 1 49 ALA CA 1 49 ALA C -84.30 -44.30 -68.64 -83.70 -64.09 . . 0 "[ . 1 . 2]"
66 PSI 1 49 ALA N 1 49 ALA CA 1 49 ALA C 1 50 CYS N -58.80 -17.60 -39.61 -59.63 -16.73 0.87 20 0 "[ . 1 . 2]"
67 PHI 1 49 ALA C 1 50 CYS N 1 50 CYS CA 1 50 CYS C -84.60 -44.60 -68.27 -64.87 -66.25 . . 0 "[ . 1 . 2]"
68 PSI 1 50 CYS N 1 50 CYS CA 1 50 CYS C 1 51 VAL N -61.10 -21.10 -47.99 -61.88 -32.45 0.78 20 0 "[ . 1 . 2]"
69 PHI 1 50 CYS C 1 51 VAL N 1 51 VAL CA 1 51 VAL C -80.40 -40.40 -65.29 -64.59 -65.13 . . 0 "[ . 1 . 2]"
70 PSI 1 51 VAL N 1 51 VAL CA 1 51 VAL C 1 52 ASP N -62.60 -22.60 -42.68 -52.38 -30.13 . . 0 "[ . 1 . 2]"
71 PHI 1 51 VAL C 1 52 ASP N 1 52 ASP CA 1 52 ASP C -85.70 -45.70 -66.50 -75.92 -56.34 . . 0 "[ . 1 . 2]"
72 PSI 1 52 ASP N 1 52 ASP CA 1 52 ASP C 1 53 CYS N -57.10 -11.30 -39.87 -33.97 -36.40 . . 0 "[ . 1 . 2]"
73 PHI 1 54 ALA C 1 55 LEU N 1 55 LEU CA 1 55 LEU C -87.40 -47.40 -76.39 -87.28 -64.54 . . 0 "[ . 1 . 2]"
74 PSI 1 55 LEU N 1 55 LEU CA 1 55 LEU C 1 56 GLU N 115.50 163.70 122.48 114.12 132.57 1.38 20 0 "[ . 1 . 2]"
75 PHI 1 56 GLU C 1 57 THR N 1 57 THR CA 1 57 THR C -75.60 -35.60 -54.72 -62.25 -48.67 . . 0 "[ . 1 . 2]"
76 PSI 1 57 THR N 1 57 THR CA 1 57 THR C 1 58 LYS N -70.80 -13.50 -35.24 -41.18 -26.98 . . 0 "[ . 1 . 2]"
77 PHI 1 57 THR C 1 58 LYS N 1 58 LYS CA 1 58 LYS C -82.20 -42.20 -55.75 -61.19 -50.35 . . 0 "[ . 1 . 2]"
78 PSI 1 58 LYS N 1 58 LYS CA 1 58 LYS C 1 59 THR N -62.30 -22.30 -38.09 -37.37 -38.45 . . 0 "[ . 1 . 2]"
79 PHI 1 59 THR C 1 60 VAL N 1 60 VAL CA 1 60 VAL C -80.20 -40.20 -65.65 -72.04 -60.35 . . 0 "[ . 1 . 2]"
80 PSI 1 60 VAL N 1 60 VAL CA 1 60 VAL C 1 61 PHE N -65.90 -25.90 -31.75 -28.05 -30.24 . . 0 "[ . 1 . 2]"
81 PHI 1 60 VAL C 1 61 PHE N 1 61 PHE CA 1 61 PHE C -91.30 -45.90 -74.04 -81.82 -64.23 . . 0 "[ . 1 . 2]"
82 PSI 1 61 PHE N 1 61 PHE CA 1 61 PHE C 1 62 GLY N -64.90 -9.00 -18.49 -30.05 -10.28 . . 0 "[ . 1 . 2]"
83 PHI 1 61 PHE C 1 62 GLY N 1 62 GLY CA 1 62 GLY C -127.10 -29.90 -73.74 -75.81 -77.38 . . 0 "[ . 1 . 2]"
84 PSI 1 62 GLY N 1 62 GLY CA 1 62 GLY C 1 63 TYR N -54.00 15.10 -15.41 -10.50 -13.55 . . 0 "[ . 1 . 2]"
85 PHI 1 62 GLY C 1 63 TYR N 1 63 TYR CA 1 63 TYR C -115.70 -62.30 -80.74 -94.07 -69.20 . . 0 "[ . 1 . 2]"
86 PSI 1 63 TYR N 1 63 TYR CA 1 63 TYR C 1 64 LEU N -53.10 40.50 -9.96 -37.46 10.10 . . 0 "[ . 1 . 2]"
87 PHI 1 64 LEU C 1 65 LYS N 1 65 LYS CA 1 65 LYS C -115.80 -49.40 -104.24 -119.83 -76.70 4.03 18 0 "[ . 1 . 2]"
88 PSI 1 65 LYS N 1 65 LYS CA 1 65 LYS C 1 66 PRO N 99.40 173.00 156.91 159.43 159.15 . . 0 "[ . 1 . 2]"
89 PSI 1 66 PRO N 1 66 PRO CA 1 66 PRO C 1 67 ASP N 124.50 168.30 144.71 143.07 136.65 1.86 15 0 "[ . 1 . 2]"
90 PHI 1 66 PRO C 1 67 ASP N 1 67 ASP CA 1 67 ASP C -155.70 -75.60 -132.29 -156.96 -102.57 1.26 4 0 "[ . 1 . 2]"
91 PSI 1 67 ASP N 1 67 ASP CA 1 67 ASP C 1 68 ASN N 94.10 169.20 131.48 122.32 111.77 0.44 11 0 "[ . 1 . 2]"
92 PHI 1 69 ARG C 1 70 GLY N 1 70 GLY CA 1 70 GLY C 60.60 100.60 81.07 95.09 92.19 1.38 18 0 "[ . 1 . 2]"
93 PSI 1 70 GLY N 1 70 GLY CA 1 70 GLY C 1 71 GLY N -11.40 40.80 36.54 43.55 42.59 3.20 18 0 "[ . 1 . 2]"
94 PHI 1 71 GLY C 1 72 GLU N 1 72 GLU CA 1 72 GLU C -152.80 -34.90 -81.12 -79.53 -82.26 . . 0 "[ . 1 . 2]"
95 PSI 1 72 GLU N 1 72 GLU CA 1 72 GLU C 1 73 VAL N 68.10 -166.80 169.94 162.63 -178.63 . . 0 "[ . 1 . 2]"
96 PHI 1 72 GLU C 1 73 VAL N 1 73 VAL CA 1 73 VAL C -155.30 -49.30 -135.59 -134.54 -135.64 . . 0 "[ . 1 . 2]"
97 PSI 1 73 VAL N 1 73 VAL CA 1 73 VAL C 1 74 ILE N 100.40 163.10 129.60 131.22 130.20 . . 0 "[ . 1 . 2]"
98 PHI 1 73 VAL C 1 74 ILE N 1 74 ILE CA 1 74 ILE C -136.70 -91.50 -112.10 -120.24 -103.37 . . 0 "[ . 1 . 2]"
99 PSI 1 74 ILE N 1 74 ILE CA 1 74 ILE C 1 75 THR N 116.60 156.60 129.24 121.92 143.05 . . 0 "[ . 1 . 2]"
100 PHI 1 74 ILE C 1 75 THR N 1 75 THR CA 1 75 THR C -149.00 -109.00 -106.88 -108.86 -105.51 3.49 20 0 "[ . 1 . 2]"
101 PSI 1 75 THR N 1 75 THR CA 1 75 THR C 1 76 ALA N 134.00 -178.00 143.87 133.83 154.54 0.17 12 0 "[ . 1 . 2]"
102 PHI 1 75 THR C 1 76 ALA N 1 76 ALA CA 1 76 ALA C -165.70 -114.30 -156.00 -166.83 -132.16 1.13 2 0 "[ . 1 . 2]"
103 PSI 1 76 ALA N 1 76 ALA CA 1 76 ALA C 1 77 SER N 119.00 175.00 138.35 115.95 175.59 3.05 19 0 "[ . 1 . 2]"
104 PHI 1 76 ALA C 1 77 SER N 1 77 SER CA 1 77 SER C -140.20 -67.70 -81.71 -87.15 -103.20 0.83 8 0 "[ . 1 . 2]"
105 PSI 1 77 SER N 1 77 SER CA 1 77 SER C 1 78 PHE N 103.20 179.80 110.13 100.10 124.63 3.10 4 0 "[ . 1 . 2]"
106 PHI 1 78 PHE C 1 79 ASP N 1 79 ASP CA 1 79 ASP C 36.10 76.10 63.29 55.18 71.05 . . 0 "[ . 1 . 2]"
107 PSI 1 79 ASP N 1 79 ASP CA 1 79 ASP C 1 80 GLY N 17.30 57.30 29.20 14.35 57.60 2.95 15 0 "[ . 1 . 2]"
108 PHI 1 79 ASP C 1 80 GLY N 1 80 GLY CA 1 80 GLY C 51.60 97.80 88.51 96.78 93.16 1.22 4 0 "[ . 1 . 2]"
109 PSI 1 80 GLY N 1 80 GLY CA 1 80 GLY C 1 81 GLU N -26.40 36.80 -6.90 -0.65 -3.91 . . 0 "[ . 1 . 2]"
110 PHI 1 80 GLY C 1 81 GLU N 1 81 GLU CA 1 81 GLU C -157.20 -73.60 -110.41 -136.64 -87.97 . . 0 "[ . 1 . 2]"
111 PSI 1 81 GLU N 1 81 GLU CA 1 81 GLU C 1 82 THR N 118.50 170.30 167.62 166.08 164.73 2.66 13 0 "[ . 1 . 2]"
112 PHI 1 81 GLU C 1 82 THR N 1 82 THR CA 1 82 THR C -126.70 -75.70 -99.82 -100.12 -108.92 1.03 19 0 "[ . 1 . 2]"
113 PSI 1 82 THR N 1 82 THR CA 1 82 THR C 1 83 HIS N 103.50 151.20 114.68 119.59 114.76 2.27 15 0 "[ . 1 . 2]"
114 PHI 1 82 THR C 1 83 HIS N 1 83 HIS CA 1 83 HIS C -166.40 -68.90 -107.46 -110.73 -116.80 . . 0 "[ . 1 . 2]"
115 PSI 1 83 HIS N 1 83 HIS CA 1 83 HIS C 1 84 SER N 126.60 167.90 137.37 123.29 168.75 3.31 4 0 "[ . 1 . 2]"
116 PHI 1 83 HIS C 1 84 SER N 1 84 SER CA 1 84 SER C -154.60 -91.10 -124.49 -123.69 -125.12 . . 0 "[ . 1 . 2]"
117 PSI 1 84 SER N 1 84 SER CA 1 84 SER C 1 85 ILE N 113.40 167.20 142.94 126.98 154.86 . . 0 "[ . 1 . 2]"
118 PHI 1 84 SER C 1 85 ILE N 1 85 ILE CA 1 85 ILE C -158.10 -117.20 -123.07 -132.41 -117.07 0.13 17 0 "[ . 1 . 2]"
119 PSI 1 85 ILE N 1 85 ILE CA 1 85 ILE C 1 86 GLN N 141.40 -178.60 174.05 161.70 -176.66 1.94 7 0 "[ . 1 . 2]"
120 PHI 1 85 ILE C 1 86 GLN N 1 86 GLN CA 1 86 GLN C -151.60 -60.50 -112.40 -127.28 -99.27 . . 0 "[ . 1 . 2]"
121 PSI 1 86 GLN N 1 86 GLN CA 1 86 GLN C 1 87 LEU N 123.00 163.00 148.61 140.61 154.39 . . 0 "[ . 1 . 2]"
122 PHI 1 86 GLN C 1 87 LEU N 1 87 LEU CA 1 87 LEU C -112.20 -44.30 -115.38 -115.18 -115.48 5.11 9 1 "[ . +1 . 2]"
123 PSI 1 87 LEU N 1 87 LEU CA 1 87 LEU C 1 88 PRO N 97.70 -172.60 160.88 147.48 171.43 . . 0 "[ . 1 . 2]"
124 PSI 1 88 PRO N 1 88 PRO CA 1 88 PRO C 1 89 PRO N 131.90 171.90 136.06 128.66 145.48 3.24 13 0 "[ . 1 . 2]"
125 PSI 1 89 PRO N 1 89 PRO CA 1 89 PRO C 1 90 VAL N 128.80 168.80 138.21 127.86 159.95 0.94 16 0 "[ . 1 . 2]"
126 PHI 1 89 PRO C 1 90 VAL N 1 90 VAL CA 1 90 VAL C -143.30 -61.00 -105.95 -114.70 -117.13 . . 0 "[ . 1 . 2]"
127 PSI 1 90 VAL N 1 90 VAL CA 1 90 VAL C 1 91 ASN N 106.80 171.50 168.53 164.35 161.25 3.85 18 0 "[ . 1 . 2]"
128 PHI 1 91 ASN C 1 92 SER N 1 92 SER CA 1 92 SER C 172.80 -50.40 -120.23 -126.90 -108.78 . . 0 "[ . 1 . 2]"
129 PSI 1 92 SER N 1 92 SER CA 1 92 SER C 1 93 ALA N 145.30 -174.70 140.12 141.14 140.49 8.02 16 12 "[* * . *- * ****+ **]"
130 PHI 1 92 SER C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -83.90 -43.90 -69.90 -66.64 -67.17 . . 0 "[ . 1 . 2]"
131 PSI 1 93 ALA N 1 93 ALA CA 1 93 ALA C 1 94 SER N -56.20 -16.20 -32.29 -44.06 -26.54 . . 0 "[ . 1 . 2]"
132 PHI 1 93 ALA C 1 94 SER N 1 94 SER CA 1 94 SER C -85.60 -45.60 -67.89 -74.74 -59.43 . . 0 "[ . 1 . 2]"
133 PSI 1 94 SER N 1 94 SER CA 1 94 SER C 1 95 PHE N -58.60 -18.60 -26.61 -29.40 -31.14 1.63 3 0 "[ . 1 . 2]"
134 PHI 1 94 SER C 1 95 PHE N 1 95 PHE CA 1 95 PHE C -86.20 -46.20 -84.41 -87.70 -74.07 1.50 8 0 "[ . 1 . 2]"
135 PSI 1 95 PHE N 1 95 PHE CA 1 95 PHE C 1 96 ALA N -62.90 -22.90 -24.19 -22.16 -22.52 1.81 19 0 "[ . 1 . 2]"
136 PHI 1 95 PHE C 1 96 ALA N 1 96 ALA CA 1 96 ALA C -84.10 -44.10 -50.64 -53.99 -55.26 . . 0 "[ . 1 . 2]"
137 PSI 1 96 ALA N 1 96 ALA CA 1 96 ALA C 1 97 LEU N -65.00 -25.00 -63.35 -67.51 -58.59 2.51 16 0 "[ . 1 . 2]"
138 PHI 1 96 ALA C 1 97 LEU N 1 97 LEU CA 1 97 LEU C -82.10 -42.10 -66.40 -72.27 -60.65 . . 0 "[ . 1 . 2]"
139 PSI 1 97 LEU N 1 97 LEU CA 1 97 LEU C 1 98 ARG N -59.20 -19.20 -42.90 -39.77 -41.08 . . 0 "[ . 1 . 2]"
140 PHI 1 97 LEU C 1 98 ARG N 1 98 ARG CA 1 98 ARG C -88.00 -48.00 -58.96 -65.69 -73.39 . . 0 "[ . 1 . 2]"
141 PSI 1 98 ARG N 1 98 ARG CA 1 98 ARG C 1 99 PHE N -57.20 -17.20 -33.68 -41.94 -26.66 . . 0 "[ . 1 . 2]"
142 PHI 1 98 ARG C 1 99 PHE N 1 99 PHE CA 1 99 PHE C -82.60 -42.60 -64.09 -71.74 -59.06 . . 0 "[ . 1 . 2]"
143 PSI 1 99 PHE N 1 99 PHE CA 1 99 PHE C 1 100 LEU N -67.10 -27.10 -49.51 -49.71 -51.55 . . 0 "[ . 1 . 2]"
144 PHI 1 99 PHE C 1 100 LEU N 1 100 LEU CA 1 100 LEU C -86.20 -46.20 -83.95 -89.19 -73.67 2.99 8 0 "[ . 1 . 2]"
145 PSI 1 100 LEU N 1 100 LEU CA 1 100 LEU C 1 101 GLU N -56.50 -16.50 -15.07 -14.50 -14.84 3.40 13 0 "[ . 1 . 2]"
146 PHI 1 100 LEU C 1 101 GLU N 1 101 GLU CA 1 101 GLU C -88.80 -48.80 -65.76 -58.16 -59.69 . . 0 "[ . 1 . 2]"
147 PSI 1 101 GLU N 1 101 GLU CA 1 101 GLU C 1 102 ASN N -60.40 -20.40 -45.31 -56.98 -34.44 . . 0 "[ . 1 . 2]"
148 PHI 1 101 GLU C 1 102 ASN N 1 102 ASN CA 1 102 ASN C -90.80 -50.80 -65.47 -65.63 -66.39 . . 0 "[ . 1 . 2]"
149 PSI 1 102 ASN N 1 102 ASN CA 1 102 ASN C 1 103 PHE N -54.70 -14.70 -38.44 -40.91 -42.28 . . 0 "[ . 1 . 2]"
150 PHI 1 102 ASN C 1 103 PHE N 1 103 PHE CA 1 103 PHE C -83.90 -43.90 -67.49 -67.00 -68.23 . . 0 "[ . 1 . 2]"
151 PSI 1 103 PHE N 1 103 PHE CA 1 103 PHE C 1 104 CYS N -64.40 -24.40 -49.90 -64.31 -36.60 . . 0 "[ . 1 . 2]"
152 PHI 1 103 PHE C 1 104 CYS N 1 104 CYS CA 1 104 CYS C -81.70 -41.70 -66.55 -60.90 -62.50 . . 0 "[ . 1 . 2]"
153 PSI 1 104 CYS N 1 104 CYS CA 1 104 CYS C 1 105 HIS N -62.60 -22.60 -26.80 -34.29 -21.32 1.28 6 0 "[ . 1 . 2]"
154 PHI 1 104 CYS C 1 105 HIS N 1 105 HIS CA 1 105 HIS C -85.50 -45.50 -66.82 -66.04 -66.30 . . 0 "[ . 1 . 2]"
155 PSI 1 105 HIS N 1 105 HIS CA 1 105 HIS C 1 106 SER N -59.50 -19.50 -37.82 -46.40 -32.40 . . 0 "[ . 1 . 2]"
156 PHI 1 105 HIS C 1 106 SER N 1 106 SER CA 1 106 SER C -84.30 -44.30 -72.19 -78.34 -65.81 . . 0 "[ . 1 . 2]"
157 PSI 1 106 SER N 1 106 SER CA 1 106 SER C 1 107 LEU N -51.30 -7.60 -25.53 -35.86 -7.95 . . 0 "[ . 1 . 2]"
158 PHI 1 106 SER C 1 107 LEU N 1 107 LEU CA 1 107 LEU C -112.70 -72.70 -86.53 -84.31 -97.70 0.11 13 0 "[ . 1 . 2]"
159 PSI 1 107 LEU N 1 107 LEU CA 1 107 LEU C 1 108 GLN N -17.10 28.80 -12.25 -17.94 -1.21 0.84 6 0 "[ . 1 . 2]"
160 PHI 1 107 LEU C 1 108 GLN N 1 108 GLN CA 1 108 GLN C 39.60 79.60 73.63 73.74 72.06 0.86 20 0 "[ . 1 . 2]"
161 PSI 1 108 GLN N 1 108 GLN CA 1 108 GLN C 1 109 CYS N 9.90 66.90 8.00 9.40 9.17 4.67 11 0 "[ . 1 . 2]"
162 PHI 1 108 GLN C 1 109 CYS N 1 109 CYS CA 1 109 CYS C -170.80 -57.70 -86.49 -95.05 -75.82 . . 0 "[ . 1 . 2]"
163 PSI 1 109 CYS N 1 109 CYS CA 1 109 CYS C 1 110 ASP N 135.20 -178.20 135.97 131.53 146.44 3.67 12 0 "[ . 1 . 2]"
164 PHI 1 110 ASP C 1 111 ASN N 1 111 ASN CA 1 111 ASN C 34.50 94.70 61.04 66.84 66.29 . . 0 "[ . 1 . 2]"
165 PSI 1 111 ASN N 1 111 ASN CA 1 111 ASN C 1 112 LEU N -0.20 59.10 18.56 12.62 27.10 . . 0 "[ . 1 . 2]"
166 PHI 1 111 ASN C 1 112 LEU N 1 112 LEU CA 1 112 LEU C -115.00 -57.60 -81.54 -81.48 -82.41 . . 0 "[ . 1 . 2]"
167 PSI 1 112 LEU N 1 112 LEU CA 1 112 LEU C 1 113 LEU N -73.30 25.60 -17.34 -27.15 -7.66 . . 0 "[ . 1 . 2]"
168 PHI 1 112 LEU C 1 113 LEU N 1 113 LEU CA 1 113 LEU C -164.70 -83.90 -159.66 -164.41 -152.78 . . 0 "[ . 1 . 2]"
169 PSI 1 113 LEU N 1 113 LEU CA 1 113 LEU C 1 114 SER N 113.20 -157.00 163.35 150.08 172.55 . . 0 "[ . 1 . 2]"
170 PHI 1 113 LEU C 1 114 SER N 1 114 SER CA 1 114 SER C 162.00 -64.80 -162.06 -168.06 -145.56 . . 0 "[ . 1 . 2]"
171 PSI 1 114 SER N 1 114 SER CA 1 114 SER C 1 115 SER N 111.40 172.50 124.59 126.22 121.78 2.50 3 0 "[ . 1 . 2]"
172 PHI 1 115 SER C 1 116 GLN N 1 116 GLN CA 1 116 GLN C -145.80 -69.10 -99.27 -73.73 -74.31 2.49 6 0 "[ . 1 . 2]"
173 PSI 1 116 GLN N 1 116 GLN CA 1 116 GLN C 1 117 PRO N 93.30 170.30 130.87 133.31 120.07 . . 0 "[ . 1 . 2]"
174 PSI 1 117 PRO N 1 117 PRO CA 1 117 PRO C 1 118 PHE N 131.90 173.10 165.51 135.55 176.78 3.68 16 0 "[ . 1 . 2]"
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