NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
398498 |
1tfb   |
cing | recoord | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1tfb
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 177
_TA_constraint_stats_list.Viol_count 187
_TA_constraint_stats_list.Viol_total 2127.53
_TA_constraint_stats_list.Viol_max 3.09
_TA_constraint_stats_list.Viol_rms 0.20
_TA_constraint_stats_list.Viol_average_all_restraints 0.03
_TA_constraint_stats_list.Viol_average_violations_only 0.57
_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 . 1 4 ARG C 1 5 ALA N 1 5 ALA CA 1 5 ALA C -95.00 -35.00 -63.07 -73.65 -44.12 . . 0 "[ . 1 . 2]"
2 . 1 5 ALA N 1 5 ALA CA 1 5 ALA C 1 6 MET N -80.00 0.00 -26.31 -22.91 -24.79 . . 0 "[ . 1 . 2]"
3 . 1 5 ALA C 1 6 MET N 1 6 MET CA 1 6 MET C -95.00 -35.00 -71.02 -78.10 -60.19 . . 0 "[ . 1 . 2]"
4 . 1 6 MET N 1 6 MET CA 1 6 MET C 1 7 MET N -80.00 0.00 -37.82 -33.44 -38.71 . . 0 "[ . 1 . 2]"
5 . 1 6 MET C 1 7 MET N 1 7 MET CA 1 7 MET C -95.00 -35.00 -78.36 -86.35 -62.37 . . 0 "[ . 1 . 2]"
6 . 1 7 MET N 1 7 MET CA 1 7 MET C 1 8 ASN N -80.00 0.00 -15.96 -14.27 -15.24 . . 0 "[ . 1 . 2]"
7 . 1 7 MET C 1 8 ASN N 1 8 ASN CA 1 8 ASN C -95.00 -35.00 -89.46 -95.16 -74.25 0.16 2 0 "[ . 1 . 2]"
8 . 1 8 ASN N 1 8 ASN CA 1 8 ASN C 1 9 ALA N -80.00 0.00 -21.72 -26.67 -14.98 . . 0 "[ . 1 . 2]"
9 . 1 8 ASN C 1 9 ALA N 1 9 ALA CA 1 9 ALA C -95.00 -35.00 -83.75 -86.19 -81.29 . . 0 "[ . 1 . 2]"
10 . 1 9 ALA N 1 9 ALA CA 1 9 ALA C 1 10 PHE N -80.00 0.00 -22.83 -26.33 -18.31 . . 0 "[ . 1 . 2]"
11 . 1 9 ALA C 1 10 PHE N 1 10 PHE CA 1 10 PHE C -95.00 -35.00 -77.63 -77.03 -77.28 . . 0 "[ . 1 . 2]"
12 . 1 10 PHE N 1 10 PHE CA 1 10 PHE C 1 11 LYS N -80.00 0.00 -31.13 -33.62 -28.38 . . 0 "[ . 1 . 2]"
13 . 1 10 PHE C 1 11 LYS N 1 11 LYS CA 1 11 LYS C -95.00 -35.00 -77.36 -79.55 -79.86 . . 0 "[ . 1 . 2]"
14 . 1 11 LYS N 1 11 LYS CA 1 11 LYS C 1 12 GLU N -80.00 0.00 -20.28 -20.27 -20.46 . . 0 "[ . 1 . 2]"
15 . 1 11 LYS C 1 12 GLU N 1 12 GLU CA 1 12 GLU C -95.00 -35.00 -89.47 -89.58 -89.73 . . 0 "[ . 1 . 2]"
16 . 1 12 GLU N 1 12 GLU CA 1 12 GLU C 1 13 ILE N -80.00 0.00 -19.35 -18.76 -18.76 . . 0 "[ . 1 . 2]"
17 . 1 13 ILE C 1 14 THR N 1 14 THR CA 1 14 THR C -95.00 -35.00 -87.62 -87.88 -88.43 . . 0 "[ . 1 . 2]"
18 . 1 14 THR N 1 14 THR CA 1 14 THR C 1 15 THR N -80.00 0.00 -22.81 -22.13 -22.68 . . 0 "[ . 1 . 2]"
19 . 1 14 THR C 1 15 THR N 1 15 THR CA 1 15 THR C -95.00 -35.00 -79.35 -83.81 -75.48 . . 0 "[ . 1 . 2]"
20 . 1 15 THR N 1 15 THR CA 1 15 THR C 1 16 MET N -80.00 0.00 -26.51 -29.65 -22.70 . . 0 "[ . 1 . 2]"
21 . 1 15 THR C 1 16 MET N 1 16 MET CA 1 16 MET C -95.00 -35.00 -75.60 -74.79 -76.22 . . 0 "[ . 1 . 2]"
22 . 1 16 MET N 1 16 MET CA 1 16 MET C 1 17 ALA N -80.00 0.00 -38.93 -39.21 -40.19 . . 0 "[ . 1 . 2]"
23 . 1 16 MET C 1 17 ALA N 1 17 ALA CA 1 17 ALA C -95.00 -35.00 -72.44 -77.03 -63.71 . . 0 "[ . 1 . 2]"
24 . 1 17 ALA N 1 17 ALA CA 1 17 ALA C 1 18 ASP N -80.00 0.00 -26.74 -22.61 -23.49 . . 0 "[ . 1 . 2]"
25 . 1 17 ALA C 1 18 ASP N 1 18 ASP CA 1 18 ASP C -95.00 -35.00 -75.38 -86.19 -65.59 . . 0 "[ . 1 . 2]"
26 . 1 18 ASP N 1 18 ASP CA 1 18 ASP C 1 19 ARG N -80.00 0.00 -24.36 -30.00 -3.70 . . 0 "[ . 1 . 2]"
27 . 1 18 ASP C 1 19 ARG N 1 19 ARG CA 1 19 ARG C -95.00 -35.00 -90.94 -87.67 -91.22 0.17 3 0 "[ . 1 . 2]"
28 . 1 19 ARG N 1 19 ARG CA 1 19 ARG C 1 20 ILE N -80.00 0.00 -18.25 -31.11 -10.94 . . 0 "[ . 1 . 2]"
29 . 1 19 ARG C 1 20 ILE N 1 20 ILE CA 1 20 ILE C -150.00 -90.00 -94.54 -108.57 -89.90 0.10 1 0 "[ . 1 . 2]"
30 . 1 21 ASN C 1 22 LEU N 1 22 LEU CA 1 22 LEU C -150.00 -90.00 -119.34 -136.39 -89.92 0.08 4 0 "[ . 1 . 2]"
31 . 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 PRO N 100.00 160.00 158.81 158.55 157.53 0.33 5 0 "[ . 1 . 2]"
32 . 1 23 PRO C 1 24 ARG N 1 24 ARG CA 1 24 ARG C -95.00 -35.00 -73.48 -90.96 -60.39 . . 0 "[ . 1 . 2]"
33 . 1 24 ARG N 1 24 ARG CA 1 24 ARG C 1 25 ASN N -80.00 0.00 -11.02 -9.95 -11.03 . . 0 "[ . 1 . 2]"
34 . 1 24 ARG C 1 25 ASN N 1 25 ASN CA 1 25 ASN C -95.00 -35.00 -67.22 -76.73 -55.00 . . 0 "[ . 1 . 2]"
35 . 1 25 ASN N 1 25 ASN CA 1 25 ASN C 1 26 ILE N -80.00 0.00 -41.96 -57.38 -33.03 . . 0 "[ . 1 . 2]"
36 . 1 28 ASP C 1 29 ARG N 1 29 ARG CA 1 29 ARG C -95.00 -35.00 -81.23 -80.15 -81.38 . . 0 "[ . 1 . 2]"
37 . 1 29 ARG N 1 29 ARG CA 1 29 ARG C 1 30 THR N -80.00 0.00 -46.48 -55.25 -34.77 . . 0 "[ . 1 . 2]"
38 . 1 30 THR C 1 31 ASN N 1 31 ASN CA 1 31 ASN C -95.00 -35.00 -70.44 -65.11 -68.47 . . 0 "[ . 1 . 2]"
39 . 1 31 ASN N 1 31 ASN CA 1 31 ASN C 1 32 ASN N -80.00 0.00 -32.27 -28.55 -30.96 . . 0 "[ . 1 . 2]"
40 . 1 31 ASN C 1 32 ASN N 1 32 ASN CA 1 32 ASN C -95.00 -35.00 -78.38 -87.59 -71.70 . . 0 "[ . 1 . 2]"
41 . 1 32 ASN N 1 32 ASN CA 1 32 ASN C 1 33 LEU N -80.00 0.00 -21.44 -40.69 -14.76 . . 0 "[ . 1 . 2]"
42 . 1 33 LEU C 1 34 PHE N 1 34 PHE CA 1 34 PHE C -95.00 -35.00 -76.56 -74.69 -75.18 . . 0 "[ . 1 . 2]"
43 . 1 34 PHE N 1 34 PHE CA 1 34 PHE C 1 35 LYS N -80.00 0.00 -41.78 -45.75 -31.34 . . 0 "[ . 1 . 2]"
44 . 1 34 PHE C 1 35 LYS N 1 35 LYS CA 1 35 LYS C -95.00 -35.00 -67.70 -77.32 -63.50 . . 0 "[ . 1 . 2]"
45 . 1 35 LYS N 1 35 LYS CA 1 35 LYS C 1 36 GLN N -80.00 0.00 -26.64 -20.79 -24.30 . . 0 "[ . 1 . 2]"
46 . 1 35 LYS C 1 36 GLN N 1 36 GLN CA 1 36 GLN C -95.00 -35.00 -79.25 -89.19 -71.14 . . 0 "[ . 1 . 2]"
47 . 1 36 GLN N 1 36 GLN CA 1 36 GLN C 1 37 VAL N -80.00 0.00 -27.30 -20.38 -22.90 . . 0 "[ . 1 . 2]"
48 . 1 47 ALA C 1 48 ASN N 1 48 ASN CA 1 48 ASN C -95.00 -35.00 -73.74 -66.50 -68.83 . . 0 "[ . 1 . 2]"
49 . 1 48 ASN N 1 48 ASN CA 1 48 ASN C 1 49 ASP N -80.00 0.00 -31.34 -27.65 -28.69 . . 0 "[ . 1 . 2]"
50 . 1 48 ASN C 1 49 ASP N 1 49 ASP CA 1 49 ASP C -95.00 -35.00 -78.63 -80.97 -81.60 . . 0 "[ . 1 . 2]"
51 . 1 49 ASP N 1 49 ASP CA 1 49 ASP C 1 50 ALA N -80.00 0.00 -28.29 -34.54 -21.24 . . 0 "[ . 1 . 2]"
52 . 1 49 ASP C 1 50 ALA N 1 50 ALA CA 1 50 ALA C -95.00 -35.00 -74.21 -73.71 -75.83 . . 0 "[ . 1 . 2]"
53 . 1 50 ALA N 1 50 ALA CA 1 50 ALA C 1 51 ILE N -80.00 0.00 -36.27 -40.64 -31.61 . . 0 "[ . 1 . 2]"
54 . 1 50 ALA C 1 51 ILE N 1 51 ILE CA 1 51 ILE C -95.00 -35.00 -68.74 -69.54 -71.44 . . 0 "[ . 1 . 2]"
55 . 1 51 ILE N 1 51 ILE CA 1 51 ILE C 1 52 ALA N -80.00 0.00 -34.60 -43.45 -30.70 . . 0 "[ . 1 . 2]"
56 . 1 51 ILE C 1 52 ALA N 1 52 ALA CA 1 52 ALA C -95.00 -35.00 -75.65 -74.58 -75.52 . . 0 "[ . 1 . 2]"
57 . 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 SER N -80.00 0.00 -39.46 -38.52 -40.64 . . 0 "[ . 1 . 2]"
58 . 1 53 SER C 1 54 ALA N 1 54 ALA CA 1 54 ALA C -95.00 -35.00 -60.40 -65.28 -57.04 . . 0 "[ . 1 . 2]"
59 . 1 54 ALA N 1 54 ALA CA 1 54 ALA C 1 55 CYS N -80.00 0.00 -47.09 -50.16 -51.41 . . 0 "[ . 1 . 2]"
60 . 1 56 LEU C 1 57 TYR N 1 57 TYR CA 1 57 TYR C -95.00 -35.00 -64.29 -69.96 -59.18 . . 0 "[ . 1 . 2]"
61 . 1 57 TYR N 1 57 TYR CA 1 57 TYR C 1 58 ILE N -80.00 0.00 -15.46 -27.12 -9.22 . . 0 "[ . 1 . 2]"
62 . 1 58 ILE C 1 59 ALA N 1 59 ALA CA 1 59 ALA C -95.00 -35.00 -56.33 -59.75 -61.84 . . 0 "[ . 1 . 2]"
63 . 1 59 ALA N 1 59 ALA CA 1 59 ALA C 1 60 CYS N -80.00 0.00 -26.79 -19.93 -20.95 . . 0 "[ . 1 . 2]"
64 . 1 59 ALA C 1 60 CYS N 1 60 CYS CA 1 60 CYS C -95.00 -35.00 -82.34 -85.82 -89.73 0.34 1 0 "[ . 1 . 2]"
65 . 1 60 CYS N 1 60 CYS CA 1 60 CYS C 1 61 ARG N -80.00 0.00 -40.52 -53.85 -31.10 . . 0 "[ . 1 . 2]"
66 . 1 60 CYS C 1 61 ARG N 1 61 ARG CA 1 61 ARG C -95.00 -35.00 -59.79 -58.66 -61.13 . . 0 "[ . 1 . 2]"
67 . 1 61 ARG N 1 61 ARG CA 1 61 ARG C 1 62 GLN N -80.00 0.00 -30.52 -54.59 -14.11 . . 0 "[ . 1 . 2]"
68 . 1 61 ARG C 1 62 GLN N 1 62 GLN CA 1 62 GLN C -95.00 -35.00 -73.93 -95.43 -44.14 0.43 6 0 "[ . 1 . 2]"
69 . 1 62 GLN N 1 62 GLN CA 1 62 GLN C 1 63 GLU N -80.00 0.00 -24.81 -24.96 -26.45 0.52 11 0 "[ . 1 . 2]"
70 . 1 64 GLY C 1 65 VAL N 1 65 VAL CA 1 65 VAL C -150.00 -90.00 -110.61 -131.96 -150.25 0.76 16 0 "[ . 1 . 2]"
71 . 1 68 THR C 1 69 PHE N 1 69 PHE CA 1 69 PHE C -95.00 -35.00 -61.54 -65.92 -50.10 . . 0 "[ . 1 . 2]"
72 . 1 69 PHE N 1 69 PHE CA 1 69 PHE C 1 70 LYS N -80.00 0.00 -37.55 -36.14 -36.60 . . 0 "[ . 1 . 2]"
73 . 1 69 PHE C 1 70 LYS N 1 70 LYS CA 1 70 LYS C -95.00 -35.00 -48.67 -55.73 -43.92 . . 0 "[ . 1 . 2]"
74 . 1 70 LYS N 1 70 LYS CA 1 70 LYS C 1 71 GLU N -80.00 0.00 -25.32 -22.41 -23.61 . . 0 "[ . 1 . 2]"
75 . 1 70 LYS C 1 71 GLU N 1 71 GLU CA 1 71 GLU C -95.00 -35.00 -88.29 -93.93 -73.02 . . 0 "[ . 1 . 2]"
76 . 1 71 GLU N 1 71 GLU CA 1 71 GLU C 1 72 ILE N -80.00 0.00 -41.71 -44.25 -44.75 . . 0 "[ . 1 . 2]"
77 . 1 72 ILE C 1 73 CYS N 1 73 CYS CA 1 73 CYS C -95.00 -35.00 -88.84 -95.34 -79.52 0.34 10 0 "[ . 1 . 2]"
78 . 1 73 CYS N 1 73 CYS CA 1 73 CYS C 1 74 ALA N -80.00 0.00 -30.46 -28.07 -28.70 . . 0 "[ . 1 . 2]"
79 . 1 73 CYS C 1 74 ALA N 1 74 ALA CA 1 74 ALA C -95.00 -35.00 -63.10 -62.18 -63.15 . . 0 "[ . 1 . 2]"
80 . 1 74 ALA N 1 74 ALA CA 1 74 ALA C 1 75 VAL N -80.00 0.00 -16.23 -21.61 -9.59 . . 0 "[ . 1 . 2]"
81 . 1 74 ALA C 1 75 VAL N 1 75 VAL CA 1 75 VAL C -150.00 -90.00 -89.81 -90.97 -89.13 0.87 18 0 "[ . 1 . 2]"
82 . 1 77 ARG C 1 78 ILE N 1 78 ILE CA 1 78 ILE C -150.00 -90.00 -90.35 -94.54 -89.74 0.26 18 0 "[ . 1 . 2]"
83 . 1 78 ILE N 1 78 ILE CA 1 78 ILE C 1 79 SER N 100.00 160.00 109.50 111.95 109.70 0.82 5 0 "[ . 1 . 2]"
84 . 1 79 SER C 1 80 LYS N 1 80 LYS CA 1 80 LYS C -95.00 -35.00 -75.82 -74.93 -75.19 . . 0 "[ . 1 . 2]"
85 . 1 80 LYS N 1 80 LYS CA 1 80 LYS C 1 81 LYS N -80.00 0.00 -7.13 -10.36 -4.98 . . 0 "[ . 1 . 2]"
86 . 1 80 LYS C 1 81 LYS N 1 81 LYS CA 1 81 LYS C -95.00 -35.00 -87.01 -93.31 -56.98 . . 0 "[ . 1 . 2]"
87 . 1 81 LYS N 1 81 LYS CA 1 81 LYS C 1 82 GLU N -80.00 0.00 -4.76 -2.68 -3.35 . . 0 "[ . 1 . 2]"
88 . 1 82 GLU C 1 83 ILE N 1 83 ILE CA 1 83 ILE C -95.00 -35.00 -76.32 -85.08 -44.92 . . 0 "[ . 1 . 2]"
89 . 1 83 ILE N 1 83 ILE CA 1 83 ILE C 1 84 GLY N -80.00 0.00 -37.35 -35.95 -36.78 . . 0 "[ . 1 . 2]"
90 . 1 84 GLY C 1 85 ARG N 1 85 ARG CA 1 85 ARG C -95.00 -35.00 -86.43 -95.03 -72.17 0.03 16 0 "[ . 1 . 2]"
91 . 1 85 ARG N 1 85 ARG CA 1 85 ARG C 1 86 CYS N -80.00 0.00 -58.96 -59.63 -63.39 . . 0 "[ . 1 . 2]"
92 . 1 85 ARG C 1 86 CYS N 1 86 CYS CA 1 86 CYS C -95.00 -35.00 -54.49 -67.36 -43.11 . . 0 "[ . 1 . 2]"
93 . 1 86 CYS N 1 86 CYS CA 1 86 CYS C 1 87 PHE N -80.00 0.00 -20.82 -23.50 -25.74 . . 0 "[ . 1 . 2]"
94 . 1 87 PHE C 1 88 LYS N 1 88 LYS CA 1 88 LYS C -95.00 -35.00 -66.02 -83.97 -50.02 . . 0 "[ . 1 . 2]"
95 . 1 88 LYS N 1 88 LYS CA 1 88 LYS C 1 89 LEU N -80.00 0.00 -22.25 -28.97 -14.40 . . 0 "[ . 1 . 2]"
96 . 1 88 LYS C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -95.00 -35.00 -81.54 -83.03 -84.42 . . 0 "[ . 1 . 2]"
97 . 1 89 LEU N 1 89 LEU CA 1 89 LEU C 1 90 ILE N -80.00 0.00 -38.57 -39.23 -42.61 . . 0 "[ . 1 . 2]"
98 . 1 90 ILE C 1 91 LEU N 1 91 LEU CA 1 91 LEU C -95.00 -35.00 -84.77 -88.93 -79.67 . . 0 "[ . 1 . 2]"
99 . 1 91 LEU N 1 91 LEU CA 1 91 LEU C 1 92 LYS N -80.00 0.00 -36.47 -43.42 -21.63 . . 0 "[ . 1 . 2]"
100 . 1 91 LEU C 1 92 LYS N 1 92 LYS CA 1 92 LYS C -95.00 -35.00 -65.76 -75.09 -59.59 . . 0 "[ . 1 . 2]"
101 . 1 92 LYS N 1 92 LYS CA 1 92 LYS C 1 93 ALA N -80.00 0.00 -32.05 -26.92 -28.45 . . 0 "[ . 1 . 2]"
102 . 1 92 LYS C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -95.00 -35.00 -70.26 -78.43 -58.35 . . 0 "[ . 1 . 2]"
103 . 1 93 ALA N 1 93 ALA CA 1 93 ALA C 1 94 LEU N -80.00 0.00 -14.60 -32.86 -3.01 . . 0 "[ . 1 . 2]"
104 . 1 94 LEU C 1 95 GLU N 1 95 GLU CA 1 95 GLU C -95.00 -35.00 -62.82 -95.21 -45.49 0.21 7 0 "[ . 1 . 2]"
105 . 1 106 PHE C 1 107 MET N 1 107 MET CA 1 107 MET C -95.00 -35.00 -68.14 -65.89 -65.92 . . 0 "[ . 1 . 2]"
106 . 1 107 MET N 1 107 MET CA 1 107 MET C 1 108 SER N -80.00 0.00 -53.32 -60.28 -36.53 . . 0 "[ . 1 . 2]"
107 . 1 108 SER C 1 109 ARG N 1 109 ARG CA 1 109 ARG C -95.00 -35.00 -93.53 -91.44 -91.61 0.32 17 0 "[ . 1 . 2]"
108 . 1 109 ARG N 1 109 ARG CA 1 109 ARG C 1 110 PHE N -80.00 0.00 -27.10 -31.26 -34.94 . . 0 "[ . 1 . 2]"
109 . 1 110 PHE C 1 111 CYS N 1 111 CYS CA 1 111 CYS C -95.00 -35.00 -62.34 -58.82 -64.09 . . 0 "[ . 1 . 2]"
110 . 1 111 CYS N 1 111 CYS CA 1 111 CYS C 1 112 SER N -80.00 0.00 -19.43 -27.32 -6.26 . . 0 "[ . 1 . 2]"
111 . 1 113 ASN C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -150.00 -90.00 -113.55 -149.83 -89.77 0.23 19 0 "[ . 1 . 2]"
112 . 1 115 CYS C 1 116 LEU N 1 116 LEU CA 1 116 LEU C -150.00 -90.00 -96.93 -132.18 -89.90 0.10 18 0 "[ . 1 . 2]"
113 . 1 117 PRO C 1 118 LYS N 1 118 LYS CA 1 118 LYS C -95.00 -35.00 -65.93 -59.47 -62.51 . . 0 "[ . 1 . 2]"
114 . 1 118 LYS N 1 118 LYS CA 1 118 LYS C 1 119 GLN N -80.00 0.00 -9.40 -15.41 -2.72 . . 0 "[ . 1 . 2]"
115 . 1 118 LYS C 1 119 GLN N 1 119 GLN CA 1 119 GLN C -95.00 -35.00 -66.99 -59.40 -60.11 . . 0 "[ . 1 . 2]"
116 . 1 119 GLN N 1 119 GLN CA 1 119 GLN C 1 120 VAL N -80.00 0.00 -38.81 -44.31 -27.94 . . 0 "[ . 1 . 2]"
117 . 1 120 VAL C 1 121 GLN N 1 121 GLN CA 1 121 GLN C -95.00 -35.00 -78.47 -83.29 -72.60 . . 0 "[ . 1 . 2]"
118 . 1 121 GLN N 1 121 GLN CA 1 121 GLN C 1 122 MET N -80.00 0.00 -45.13 -62.65 -33.11 . . 0 "[ . 1 . 2]"
119 . 1 121 GLN C 1 122 MET N 1 122 MET CA 1 122 MET C -95.00 -35.00 -73.27 -56.47 -64.78 . . 0 "[ . 1 . 2]"
120 . 1 122 MET N 1 122 MET CA 1 122 MET C 1 123 ALA N -80.00 0.00 -29.52 -37.73 -22.78 . . 0 "[ . 1 . 2]"
121 . 1 122 MET C 1 123 ALA N 1 123 ALA CA 1 123 ALA C -95.00 -35.00 -72.62 -68.32 -69.13 . . 0 "[ . 1 . 2]"
122 . 1 123 ALA N 1 123 ALA CA 1 123 ALA C 1 124 ALA N -80.00 0.00 -41.91 -53.58 -28.44 . . 0 "[ . 1 . 2]"
123 . 1 123 ALA C 1 124 ALA N 1 124 ALA CA 1 124 ALA C -95.00 -35.00 -63.58 -63.27 -65.89 . . 0 "[ . 1 . 2]"
124 . 1 124 ALA N 1 124 ALA CA 1 124 ALA C 1 125 THR N -80.00 0.00 -35.31 -33.95 -36.07 . . 0 "[ . 1 . 2]"
125 . 1 125 THR C 1 126 HIS N 1 126 HIS CA 1 126 HIS C -95.00 -35.00 -60.88 -56.57 -62.21 . . 0 "[ . 1 . 2]"
126 . 1 126 HIS N 1 126 HIS CA 1 126 HIS C 1 127 ILE N -80.00 0.00 -31.86 -37.30 -40.33 . . 0 "[ . 1 . 2]"
127 . 1 127 ILE C 1 128 ALA N 1 128 ALA CA 1 128 ALA C -95.00 -35.00 -78.98 -88.21 -66.50 . . 0 "[ . 1 . 2]"
128 . 1 128 ALA N 1 128 ALA CA 1 128 ALA C 1 129 ARG N -80.00 0.00 -15.49 -4.18 -7.11 . . 0 "[ . 1 . 2]"
129 . 1 128 ALA C 1 129 ARG N 1 129 ARG CA 1 129 ARG C -95.00 -35.00 -76.32 -84.56 -62.98 . . 0 "[ . 1 . 2]"
130 . 1 129 ARG N 1 129 ARG CA 1 129 ARG C 1 130 LYS N -80.00 0.00 -47.31 -60.58 -24.43 . . 0 "[ . 1 . 2]"
131 . 1 130 LYS C 1 131 ALA N 1 131 ALA CA 1 131 ALA C -95.00 -35.00 -69.90 -81.64 -52.37 . . 0 "[ . 1 . 2]"
132 . 1 131 ALA N 1 131 ALA CA 1 131 ALA C 1 132 VAL N -80.00 0.00 -45.70 -36.73 -41.49 . . 0 "[ . 1 . 2]"
133 . 1 132 VAL C 1 133 GLU N 1 133 GLU CA 1 133 GLU C -95.00 -35.00 -70.01 -82.38 -45.04 . . 0 "[ . 1 . 2]"
134 . 1 133 GLU N 1 133 GLU CA 1 133 GLU C 1 134 LEU N -80.00 0.00 -22.99 -43.90 -5.63 . . 0 "[ . 1 . 2]"
135 . 1 143 ILE C 1 144 SER N 1 144 SER CA 1 144 SER C -95.00 -35.00 -57.86 -56.46 -57.09 . . 0 "[ . 1 . 2]"
136 . 1 144 SER N 1 144 SER CA 1 144 SER C 1 145 VAL N -80.00 0.00 -44.24 -59.07 -28.85 . . 0 "[ . 1 . 2]"
137 . 1 144 SER C 1 145 VAL N 1 145 VAL CA 1 145 VAL C -95.00 -35.00 -61.60 -60.93 -65.26 . . 0 "[ . 1 . 2]"
138 . 1 145 VAL N 1 145 VAL CA 1 145 VAL C 1 146 ALA N -80.00 0.00 -24.70 -43.06 -17.92 . . 0 "[ . 1 . 2]"
139 . 1 145 VAL C 1 146 ALA N 1 146 ALA CA 1 146 ALA C -95.00 -35.00 -64.84 -65.77 -67.18 . . 0 "[ . 1 . 2]"
140 . 1 146 ALA N 1 146 ALA CA 1 146 ALA C 1 147 ALA N -80.00 0.00 -43.52 -41.63 -43.17 . . 0 "[ . 1 . 2]"
141 . 1 146 ALA C 1 147 ALA N 1 147 ALA CA 1 147 ALA C -95.00 -35.00 -75.82 -87.52 -63.56 . . 0 "[ . 1 . 2]"
142 . 1 147 ALA N 1 147 ALA CA 1 147 ALA C 1 148 ALA N -80.00 0.00 -28.99 -38.67 -13.80 . . 0 "[ . 1 . 2]"
143 . 1 147 ALA C 1 148 ALA N 1 148 ALA CA 1 148 ALA C -95.00 -35.00 -75.91 -82.54 -83.26 . . 0 "[ . 1 . 2]"
144 . 1 148 ALA N 1 148 ALA CA 1 148 ALA C 1 149 ALA N -80.00 0.00 -21.36 -20.88 -21.33 . . 0 "[ . 1 . 2]"
145 . 1 148 ALA C 1 149 ALA N 1 149 ALA CA 1 149 ALA C -95.00 -35.00 -83.38 -90.40 -76.29 . . 0 "[ . 1 . 2]"
146 . 1 149 ALA N 1 149 ALA CA 1 149 ALA C 1 150 ILE N -80.00 0.00 -27.73 -33.83 -21.36 . . 0 "[ . 1 . 2]"
147 . 1 151 TYR C 1 152 MET N 1 152 MET CA 1 152 MET C -95.00 -35.00 -72.37 -79.96 -86.40 . . 0 "[ . 1 . 2]"
148 . 1 152 MET N 1 152 MET CA 1 152 MET C 1 153 ALA N -80.00 0.00 -27.81 -50.50 -15.02 . . 0 "[ . 1 . 2]"
149 . 1 152 MET C 1 153 ALA N 1 153 ALA CA 1 153 ALA C -95.00 -35.00 -75.93 -72.97 -75.05 0.15 16 0 "[ . 1 . 2]"
150 . 1 153 ALA N 1 153 ALA CA 1 153 ALA C 1 154 SER N -80.00 0.00 -28.21 -51.77 -3.31 . . 0 "[ . 1 . 2]"
151 . 1 153 ALA C 1 154 SER N 1 154 SER CA 1 154 SER C -95.00 -35.00 -64.21 -60.82 -62.20 . . 0 "[ . 1 . 2]"
152 . 1 154 SER N 1 154 SER CA 1 154 SER C 1 155 GLN N -80.00 0.00 -26.63 -43.50 -8.73 . . 0 "[ . 1 . 2]"
153 . 1 156 ALA C 1 157 SER N 1 157 SER CA 1 157 SER C -150.00 -90.00 -111.88 -150.25 -89.12 0.88 9 0 "[ . 1 . 2]"
154 . 1 158 ALA C 1 159 GLU N 1 159 GLU CA 1 159 GLU C -150.00 -90.00 -134.35 -144.11 -124.10 . . 0 "[ . 1 . 2]"
155 . 1 159 GLU N 1 159 GLU CA 1 159 GLU C 1 160 LYS N 100.00 160.00 98.87 97.87 99.58 2.13 14 0 "[ . 1 . 2]"
156 . 1 162 THR C 1 163 GLN N 1 163 GLN CA 1 163 GLN C -95.00 -35.00 -55.61 -69.16 -35.40 . . 0 "[ . 1 . 2]"
157 . 1 163 GLN N 1 163 GLN CA 1 163 GLN C 1 164 LYS N -80.00 0.00 -18.70 -28.32 -7.89 . . 0 "[ . 1 . 2]"
158 . 1 163 GLN C 1 164 LYS N 1 164 LYS CA 1 164 LYS C -95.00 -35.00 -87.12 -93.06 -73.35 . . 0 "[ . 1 . 2]"
159 . 1 164 LYS N 1 164 LYS CA 1 164 LYS C 1 165 GLU N -80.00 0.00 -56.76 -36.22 -45.19 . . 0 "[ . 1 . 2]"
160 . 1 164 LYS C 1 165 GLU N 1 165 GLU CA 1 165 GLU C -95.00 -35.00 -76.92 -92.04 -57.88 . . 0 "[ . 1 . 2]"
161 . 1 165 GLU N 1 165 GLU CA 1 165 GLU C 1 166 ILE N -80.00 0.00 -0.93 -15.27 2.09 2.09 3 0 "[ . 1 . 2]"
162 . 1 167 GLY C 1 168 ASP N 1 168 ASP CA 1 168 ASP C -95.00 -35.00 -76.95 -95.26 -47.88 0.26 11 0 "[ . 1 . 2]"
163 . 1 168 ASP N 1 168 ASP CA 1 168 ASP C 1 169 ILE N -80.00 0.00 -34.78 -29.52 -30.80 . . 0 "[ . 1 . 2]"
164 . 1 173 ALA C 1 174 ASP N 1 174 ASP CA 1 174 ASP C -95.00 -35.00 -70.91 -69.86 -70.03 . . 0 "[ . 1 . 2]"
165 . 1 174 ASP N 1 174 ASP CA 1 174 ASP C 1 175 VAL N -80.00 0.00 -13.89 -22.53 0.62 0.62 6 0 "[ . 1 . 2]"
166 . 1 175 VAL C 1 176 THR N 1 176 THR CA 1 176 THR C -95.00 -35.00 -96.83 -98.09 -95.10 3.09 18 0 "[ . 1 . 2]"
167 . 1 176 THR N 1 176 THR CA 1 176 THR C 1 177 ILE N -80.00 0.00 -40.31 -45.28 -28.81 . . 0 "[ . 1 . 2]"
168 . 1 177 ILE C 1 178 ARG N 1 178 ARG CA 1 178 ARG C -95.00 -35.00 -77.97 -86.32 -67.91 . . 0 "[ . 1 . 2]"
169 . 1 178 ARG N 1 178 ARG CA 1 178 ARG C 1 179 GLN N -80.00 0.00 -31.85 -41.96 -25.16 . . 0 "[ . 1 . 2]"
170 . 1 178 ARG C 1 179 GLN N 1 179 GLN CA 1 179 GLN C -95.00 -35.00 -90.78 -93.79 -94.34 1.14 17 0 "[ . 1 . 2]"
171 . 1 179 GLN N 1 179 GLN CA 1 179 GLN C 1 180 SER N -80.00 0.00 -10.22 -23.38 -2.60 . . 0 "[ . 1 . 2]"
172 . 1 179 GLN C 1 180 SER N 1 180 SER CA 1 180 SER C -95.00 -35.00 -80.56 -76.94 -78.67 . . 0 "[ . 1 . 2]"
173 . 1 180 SER N 1 180 SER CA 1 180 SER C 1 181 TYR N -80.00 0.00 -53.16 -71.93 -39.98 . . 0 "[ . 1 . 2]"
174 . 1 180 SER C 1 181 TYR N 1 181 TYR CA 1 181 TYR C -95.00 -35.00 -88.78 -95.28 -95.43 0.93 15 0 "[ . 1 . 2]"
175 . 1 181 TYR N 1 181 TYR CA 1 181 TYR C 1 182 ARG N -80.00 0.00 -17.45 -10.56 -12.45 . . 0 "[ . 1 . 2]"
176 . 1 181 TYR C 1 182 ARG N 1 182 ARG CA 1 182 ARG C -95.00 -35.00 -52.19 -76.10 -43.77 . . 0 "[ . 1 . 2]"
177 . 1 182 ARG N 1 182 ARG CA 1 182 ARG C 1 183 LEU N -80.00 0.00 -23.63 -41.88 0.04 0.04 17 0 "[ . 1 . 2]"
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