NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
522791 |
2lc0   |
17585 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2lc0
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 186
_TA_constraint_stats_list.Viol_count 443
_TA_constraint_stats_list.Viol_total 11808.59
_TA_constraint_stats_list.Viol_max 5.93
_TA_constraint_stats_list.Viol_rms 0.33
_TA_constraint_stats_list.Viol_average_all_restraints 0.07
_TA_constraint_stats_list.Viol_average_violations_only 0.89
_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 21 ASP C 1 22 ALA N 1 22 ALA CA 1 22 ALA C -84.00 -44.00 -58.89 -67.51 -43.95 0.05 26 0 "[ . 1 . 2 . 3]"
2 . 1 22 ALA N 1 22 ALA CA 1 22 ALA C 1 23 PHE N -60.00 -20.00 -48.37 -60.62 -35.65 0.62 3 0 "[ . 1 . 2 . 3]"
3 . 1 22 ALA C 1 23 PHE N 1 23 PHE CA 1 23 PHE C -85.00 -45.00 -65.81 -80.51 -51.78 . . 0 "[ . 1 . 2 . 3]"
4 . 1 23 PHE N 1 23 PHE CA 1 23 PHE C 1 24 ALA N -63.00 -23.00 -37.35 -41.20 -42.61 . . 0 "[ . 1 . 2 . 3]"
5 . 1 23 PHE C 1 24 ALA N 1 24 ALA CA 1 24 ALA C -83.00 -43.00 -63.17 -73.76 -54.85 . . 0 "[ . 1 . 2 . 3]"
6 . 1 24 ALA N 1 24 ALA CA 1 24 ALA C 1 25 ARG N -62.00 -10.00 -40.57 -36.95 -37.75 . . 0 "[ . 1 . 2 . 3]"
7 . 1 24 ALA C 1 25 ARG N 1 25 ARG CA 1 25 ARG C -81.00 -41.00 -73.51 -81.77 -64.55 0.77 30 0 "[ . 1 . 2 . 3]"
8 . 1 25 ARG N 1 25 ARG CA 1 25 ARG C 1 26 ILE N -60.00 -20.00 -30.51 -21.83 -24.14 0.53 30 0 "[ . 1 . 2 . 3]"
9 . 1 25 ARG C 1 26 ILE N 1 26 ILE CA 1 26 ILE C -92.00 -52.00 -73.92 -88.60 -60.92 . . 0 "[ . 1 . 2 . 3]"
10 . 1 26 ILE N 1 26 ILE CA 1 26 ILE C 1 27 PHE N -62.00 -10.00 -47.96 -59.42 -16.24 . . 0 "[ . 1 . 2 . 3]"
11 . 1 26 ILE C 1 27 PHE N 1 27 PHE CA 1 27 PHE C -118.00 -66.00 -81.32 -102.25 -65.71 0.29 14 0 "[ . 1 . 2 . 3]"
12 . 1 27 PHE N 1 27 PHE CA 1 27 PHE C 1 28 GLY N -28.00 12.00 -24.51 -30.19 -1.58 2.19 11 0 "[ . 1 . 2 . 3]"
13 . 1 31 ILE C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -140.00 -50.00 -110.91 -106.53 -109.01 0.52 5 0 "[ . 1 . 2 . 3]"
14 . 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 PRO N 90.00 180.00 120.72 113.74 106.31 3.54 25 0 "[ . 1 . 2 . 3]"
15 . 1 35 GLU C 1 36 VAL N 1 36 VAL CA 1 36 VAL C -84.30 -44.30 -67.17 -74.15 -56.22 . . 0 "[ . 1 . 2 . 3]"
16 . 1 36 VAL N 1 36 VAL CA 1 36 VAL C 1 37 GLU N -60.90 -20.90 -48.99 -45.69 -46.87 . . 0 "[ . 1 . 2 . 3]"
17 . 1 36 VAL C 1 37 GLU N 1 37 GLU CA 1 37 GLU C -81.30 -41.30 -61.36 -71.50 -52.02 . . 0 "[ . 1 . 2 . 3]"
18 . 1 37 GLU N 1 37 GLU CA 1 37 GLU C 1 38 ALA N -60.10 -20.10 -40.00 -55.30 -25.47 . . 0 "[ . 1 . 2 . 3]"
19 . 1 37 GLU C 1 38 ALA N 1 38 ALA CA 1 38 ALA C -83.80 -43.80 -59.98 -66.77 -48.94 . . 0 "[ . 1 . 2 . 3]"
20 . 1 38 ALA N 1 38 ALA CA 1 38 ALA C 1 39 LEU N -61.60 -21.60 -46.45 -51.20 -52.89 . . 0 "[ . 1 . 2 . 3]"
21 . 1 38 ALA C 1 39 LEU N 1 39 LEU CA 1 39 LEU C -84.40 -44.40 -68.80 -71.59 -72.87 . . 0 "[ . 1 . 2 . 3]"
22 . 1 39 LEU N 1 39 LEU CA 1 39 LEU C 1 40 LEU N -64.20 -24.20 -38.39 -47.34 -23.92 0.28 30 0 "[ . 1 . 2 . 3]"
23 . 1 39 LEU C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -84.00 -44.00 -65.48 -65.30 -65.59 . . 0 "[ . 1 . 2 . 3]"
24 . 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 ARG N -64.80 -24.80 -41.47 -44.79 -46.11 . . 0 "[ . 1 . 2 . 3]"
25 . 1 40 LEU C 1 41 ARG N 1 41 ARG CA 1 41 ARG C -79.50 -39.50 -69.06 -71.08 -71.09 . . 0 "[ . 1 . 2 . 3]"
26 . 1 41 ARG N 1 41 ARG CA 1 41 ARG C 1 42 ARG N -61.60 -21.60 -30.95 -43.23 -21.86 . . 0 "[ . 1 . 2 . 3]"
27 . 1 41 ARG C 1 42 ARG N 1 42 ARG CA 1 42 ARG C -82.30 -42.30 -68.66 -76.38 -62.74 . . 0 "[ . 1 . 2 . 3]"
28 . 1 42 ARG N 1 42 ARG CA 1 42 ARG C 1 43 GLU N -66.00 -26.00 -42.62 -41.89 -42.38 . . 0 "[ . 1 . 2 . 3]"
29 . 1 42 ARG C 1 43 GLU N 1 43 GLU CA 1 43 GLU C -86.30 -46.30 -64.95 -61.54 -62.72 . . 0 "[ . 1 . 2 . 3]"
30 . 1 43 GLU N 1 43 GLU CA 1 43 GLU C 1 44 ALA N -59.10 -19.10 -38.16 -48.66 -23.73 . . 0 "[ . 1 . 2 . 3]"
31 . 1 43 GLU C 1 44 ALA N 1 44 ALA CA 1 44 ALA C -82.90 -42.90 -61.09 -64.22 -52.94 . . 0 "[ . 1 . 2 . 3]"
32 . 1 44 ALA N 1 44 ALA CA 1 44 ALA C 1 45 ALA N -64.80 -24.80 -45.38 -49.75 -39.01 . . 0 "[ . 1 . 2 . 3]"
33 . 1 44 ALA C 1 45 ALA N 1 45 ALA CA 1 45 ALA C -80.30 -40.30 -71.37 -79.25 -63.41 . . 0 "[ . 1 . 2 . 3]"
34 . 1 45 ALA N 1 45 ALA CA 1 45 ALA C 1 46 ASP N -63.10 -23.10 -30.40 -34.23 -35.17 0.26 26 0 "[ . 1 . 2 . 3]"
35 . 1 45 ALA C 1 46 ASP N 1 46 ASP CA 1 46 ASP C -118.00 -38.40 -76.41 -72.51 -75.14 . . 0 "[ . 1 . 2 . 3]"
36 . 1 46 ASP N 1 46 ASP CA 1 46 ASP C 1 47 GLY N -65.40 7.20 -34.98 -46.11 -13.54 . . 0 "[ . 1 . 2 . 3]"
37 . 1 47 GLY C 1 48 ILE N 1 48 ILE CA 1 48 ILE C -161.90 -21.90 -64.77 -63.04 -63.88 . . 0 "[ . 1 . 2 . 3]"
38 . 1 48 ILE N 1 48 ILE CA 1 48 ILE C 1 49 GLN N 68.00 -152.00 133.41 123.23 144.73 . . 0 "[ . 1 . 2 . 3]"
39 . 1 48 ILE C 1 49 GLN N 1 49 GLN CA 1 49 GLN C 176.90 -43.10 -116.11 -127.91 -105.45 . . 0 "[ . 1 . 2 . 3]"
40 . 1 49 GLN N 1 49 GLN CA 1 49 GLN C 1 50 SER N 75.70 -174.10 140.14 132.28 128.27 . . 0 "[ . 1 . 2 . 3]"
41 . 1 49 GLN C 1 50 SER N 1 50 SER CA 1 50 SER C -156.40 -16.40 -73.71 -86.38 -60.90 . . 0 "[ . 1 . 2 . 3]"
42 . 1 50 SER N 1 50 SER CA 1 50 SER C 1 51 LEU N 91.90 150.70 114.28 111.75 109.27 0.28 17 0 "[ . 1 . 2 . 3]"
43 . 1 50 SER C 1 51 LEU N 1 51 LEU CA 1 51 LEU C -152.10 -68.50 -125.52 -150.69 -98.90 . . 0 "[ . 1 . 2 . 3]"
44 . 1 51 LEU N 1 51 LEU CA 1 51 LEU C 1 52 GLN N 111.60 -166.60 -166.39 -176.94 -163.92 2.68 16 0 "[ . 1 . 2 . 3]"
45 . 1 51 LEU C 1 52 GLN N 1 52 GLN CA 1 52 GLN C -90.00 -42.80 -49.57 -62.92 -41.41 1.39 16 0 "[ . 1 . 2 . 3]"
46 . 1 52 GLN N 1 52 GLN CA 1 52 GLN C 1 53 GLY N 114.50 167.50 147.33 126.03 166.56 . . 0 "[ . 1 . 2 . 3]"
47 . 1 53 GLY C 1 54 ASN N 1 54 ASN CA 1 54 ASN C -104.10 -62.70 -73.95 -72.63 -73.34 1.10 17 0 "[ . 1 . 2 . 3]"
48 . 1 54 ASN N 1 54 ASN CA 1 54 ASN C 1 55 ARG N -50.30 9.70 -39.68 -40.02 -42.79 . . 0 "[ . 1 . 2 . 3]"
49 . 1 54 ASN C 1 55 ARG N 1 55 ARG CA 1 55 ARG C 156.40 -63.60 -169.16 177.35 -151.77 . . 0 "[ . 1 . 2 . 3]"
50 . 1 55 ARG N 1 55 ARG CA 1 55 ARG C 1 56 LEU N 111.30 167.10 149.60 114.42 167.77 0.67 30 0 "[ . 1 . 2 . 3]"
51 . 1 55 ARG C 1 56 LEU N 1 56 LEU CA 1 56 LEU C -154.40 -92.40 -91.54 -90.76 -90.87 2.03 4 0 "[ . 1 . 2 . 3]"
52 . 1 56 LEU N 1 56 LEU CA 1 56 LEU C 1 57 LEU N 103.80 150.60 151.71 152.17 151.92 1.88 18 0 "[ . 1 . 2 . 3]"
53 . 1 56 LEU C 1 57 LEU N 1 57 LEU CA 1 57 LEU C -149.60 -66.80 -89.87 -80.88 -84.25 . . 0 "[ . 1 . 2 . 3]"
54 . 1 57 LEU N 1 57 LEU CA 1 57 LEU C 1 58 ALA N 99.10 150.30 126.55 125.00 122.14 . . 0 "[ . 1 . 2 . 3]"
55 . 1 57 LEU C 1 58 ALA N 1 58 ALA CA 1 58 ALA C -161.40 -95.20 -112.67 -122.26 -95.37 . . 0 "[ . 1 . 2 . 3]"
56 . 1 58 ALA N 1 58 ALA CA 1 58 ALA C 1 59 PRO N 90.60 165.20 158.74 156.28 155.03 0.67 6 0 "[ . 1 . 2 . 3]"
57 . 1 60 ASN C 1 61 GLU N 1 61 GLU CA 1 61 GLU C -164.70 -56.10 -102.85 -101.35 -102.08 . . 0 "[ . 1 . 2 . 3]"
58 . 1 61 GLU N 1 61 GLU CA 1 61 GLU C 1 62 TYR N 99.80 162.80 112.21 100.26 127.71 . . 0 "[ . 1 . 2 . 3]"
59 . 1 61 GLU C 1 62 TYR N 1 62 TYR CA 1 62 TYR C -146.40 -80.80 -115.63 -116.88 -118.54 . . 0 "[ . 1 . 2 . 3]"
60 . 1 62 TYR N 1 62 TYR CA 1 62 TYR C 1 63 ILE N 115.10 157.70 119.10 114.13 132.00 0.97 24 0 "[ . 1 . 2 . 3]"
61 . 1 62 TYR C 1 63 ILE N 1 63 ILE CA 1 63 ILE C -141.10 -98.30 -108.73 -127.60 -97.60 0.70 1 0 "[ . 1 . 2 . 3]"
62 . 1 63 ILE N 1 63 ILE CA 1 63 ILE C 1 64 ILE N 104.20 147.20 115.59 114.09 111.90 . . 0 "[ . 1 . 2 . 3]"
63 . 1 63 ILE C 1 64 ILE N 1 64 ILE CA 1 64 ILE C -144.90 -85.10 -109.73 -118.11 -96.49 . . 0 "[ . 1 . 2 . 3]"
64 . 1 64 ILE N 1 64 ILE CA 1 64 ILE C 1 65 THR N 101.90 143.70 119.35 115.28 112.18 0.16 24 0 "[ . 1 . 2 . 3]"
65 . 1 64 ILE C 1 65 THR N 1 65 THR CA 1 65 THR C -140.90 -81.10 -113.00 -109.06 -109.53 . . 0 "[ . 1 . 2 . 3]"
66 . 1 65 THR N 1 65 THR CA 1 65 THR C 1 66 LEU N 105.90 150.90 124.44 128.25 126.58 . . 0 "[ . 1 . 2 . 3]"
67 . 1 65 THR C 1 66 LEU N 1 66 LEU CA 1 66 LEU C -161.80 -87.60 -114.47 -132.44 -99.38 . . 0 "[ . 1 . 2 . 3]"
68 . 1 66 LEU N 1 66 LEU CA 1 66 LEU C 1 67 GLY N 114.50 -177.10 169.80 156.14 -176.78 0.32 10 0 "[ . 1 . 2 . 3]"
69 . 1 66 LEU C 1 67 GLY N 1 67 GLY CA 1 67 GLY C -99.30 -59.30 -75.14 -92.70 -63.64 . . 0 "[ . 1 . 2 . 3]"
70 . 1 67 GLY N 1 67 GLY CA 1 67 GLY C 1 68 VAL N 145.40 -174.60 161.22 164.90 163.64 0.72 9 0 "[ . 1 . 2 . 3]"
71 . 1 67 GLY C 1 68 VAL N 1 68 VAL CA 1 68 VAL C -78.20 -38.20 -60.34 -74.68 -46.20 . . 0 "[ . 1 . 2 . 3]"
72 . 1 68 VAL N 1 68 VAL CA 1 68 VAL C 1 69 HIS N -63.90 -23.90 -43.01 -41.01 -42.01 . . 0 "[ . 1 . 2 . 3]"
73 . 1 68 VAL C 1 69 HIS N 1 69 HIS CA 1 69 HIS C -82.10 -42.10 -65.50 -77.35 -53.44 . . 0 "[ . 1 . 2 . 3]"
74 . 1 69 HIS N 1 69 HIS CA 1 69 HIS C 1 70 ASP N -62.80 -22.80 -36.80 -28.89 -29.90 0.85 8 0 "[ . 1 . 2 . 3]"
75 . 1 69 HIS C 1 70 ASP N 1 70 ASP CA 1 70 ASP C -85.40 -45.40 -74.88 -72.37 -74.25 1.83 21 0 "[ . 1 . 2 . 3]"
76 . 1 70 ASP N 1 70 ASP CA 1 70 ASP C 1 71 PHE N -60.90 -20.90 -36.18 -44.33 -45.79 0.88 21 0 "[ . 1 . 2 . 3]"
77 . 1 70 ASP C 1 71 PHE N 1 71 PHE CA 1 71 PHE C -83.70 -43.70 -65.02 -73.87 -57.94 . . 0 "[ . 1 . 2 . 3]"
78 . 1 71 PHE N 1 71 PHE CA 1 71 PHE C 1 72 GLU N -62.80 -22.80 -34.62 -37.78 -39.44 0.06 23 0 "[ . 1 . 2 . 3]"
79 . 1 71 PHE C 1 72 GLU N 1 72 GLU CA 1 72 GLU C -85.60 -45.60 -63.47 -73.41 -53.79 . . 0 "[ . 1 . 2 . 3]"
80 . 1 72 GLU N 1 72 GLU CA 1 72 GLU C 1 73 LYS N -53.70 -7.70 -31.69 -31.87 -33.56 . . 0 "[ . 1 . 2 . 3]"
81 . 1 72 GLU C 1 73 LYS N 1 73 LYS CA 1 73 LYS C -86.70 -46.70 -77.48 -70.63 -73.14 . . 0 "[ . 1 . 2 . 3]"
82 . 1 73 LYS N 1 73 LYS CA 1 73 LYS C 1 74 LEU N -54.90 -14.90 -27.41 -39.16 -14.64 0.26 4 0 "[ . 1 . 2 . 3]"
83 . 1 73 LYS C 1 74 LEU N 1 74 LEU CA 1 74 LEU C -96.80 -52.80 -70.06 -97.02 -55.78 0.22 23 0 "[ . 1 . 2 . 3]"
84 . 1 74 LEU N 1 74 LEU CA 1 74 LEU C 1 75 GLY N -53.10 -7.70 -35.48 -31.62 -33.25 . . 0 "[ . 1 . 2 . 3]"
85 . 1 75 GLY C 1 76 ALA N 1 76 ALA CA 1 76 ALA C -94.00 -44.00 -82.54 -95.11 -61.53 1.11 25 0 "[ . 1 . 2 . 3]"
86 . 1 76 ALA N 1 76 ALA CA 1 76 ALA C 1 77 ASP N -45.00 1.00 -15.63 -6.92 -10.36 5.93 27 1 "[ . 1 . 2 . + 3]"
87 . 1 76 ALA C 1 77 ASP N 1 77 ASP CA 1 77 ASP C -164.60 -47.00 -114.66 -160.35 -43.05 3.95 22 0 "[ . 1 . 2 . 3]"
88 . 1 77 ASP N 1 77 ASP CA 1 77 ASP C 1 78 PRO N 36.70 174.50 97.43 49.19 138.22 . . 0 "[ . 1 . 2 . 3]"
89 . 1 77 ASP C 1 78 PRO N 1 78 PRO CA 1 78 PRO C -75.20 -35.20 -70.71 -78.47 -38.07 3.27 14 0 "[ . 1 . 2 . 3]"
90 . 1 78 PRO N 1 78 PRO CA 1 78 PRO C 1 79 GLU N -51.00 -11.00 -38.29 -52.47 -17.16 1.47 27 0 "[ . 1 . 2 . 3]"
91 . 1 78 PRO C 1 79 GLU N 1 79 GLU CA 1 79 GLU C -84.00 -44.00 -64.13 -48.02 -50.86 2.54 17 0 "[ . 1 . 2 . 3]"
92 . 1 79 GLU N 1 79 GLU CA 1 79 GLU C 1 80 LEU N -52.70 -12.70 -37.26 -54.30 -12.16 1.60 2 0 "[ . 1 . 2 . 3]"
93 . 1 79 GLU C 1 80 LEU N 1 80 LEU CA 1 80 LEU C -85.10 -45.10 -66.59 -70.96 -72.21 1.85 18 0 "[ . 1 . 2 . 3]"
94 . 1 80 LEU N 1 80 LEU CA 1 80 LEU C 1 81 LYS N -55.80 -15.80 -40.94 -56.48 -15.82 0.68 27 0 "[ . 1 . 2 . 3]"
95 . 1 80 LEU C 1 81 LYS N 1 81 LYS CA 1 81 LYS C -100.50 -35.70 -77.49 -99.88 -58.67 . . 0 "[ . 1 . 2 . 3]"
96 . 1 81 LYS N 1 81 LYS CA 1 81 LYS C 1 82 SER N -61.30 10.50 -32.47 -27.06 -31.27 . . 0 "[ . 1 . 2 . 3]"
97 . 1 81 LYS C 1 82 SER N 1 82 SER CA 1 82 SER C -83.00 -43.00 -64.18 -75.80 -54.65 . . 0 "[ . 1 . 2 . 3]"
98 . 1 82 SER N 1 82 SER CA 1 82 SER C 1 83 THR N -62.20 -13.60 -45.53 -36.43 -40.41 0.52 22 0 "[ . 1 . 2 . 3]"
99 . 1 82 SER C 1 83 THR N 1 83 THR CA 1 83 THR C -82.20 -42.20 -63.80 -73.76 -56.07 . . 0 "[ . 1 . 2 . 3]"
100 . 1 83 THR N 1 83 THR CA 1 83 THR C 1 84 GLY N -65.10 -25.10 -41.32 -38.61 -39.23 . . 0 "[ . 1 . 2 . 3]"
101 . 1 83 THR C 1 84 GLY N 1 84 GLY CA 1 84 GLY C -82.80 -42.80 -64.88 -66.83 -67.69 . . 0 "[ . 1 . 2 . 3]"
102 . 1 84 GLY N 1 84 GLY CA 1 84 GLY C 1 85 PHE N -61.50 -21.50 -48.63 -47.34 -48.93 0.14 4 0 "[ . 1 . 2 . 3]"
103 . 1 84 GLY C 1 85 PHE N 1 85 PHE CA 1 85 PHE C -86.80 -46.80 -67.64 -75.97 -58.52 . . 0 "[ . 1 . 2 . 3]"
104 . 1 85 PHE N 1 85 PHE CA 1 85 PHE C 1 86 ALA N -59.90 -19.90 -33.01 -33.03 -35.47 . . 0 "[ . 1 . 2 . 3]"
105 . 1 85 PHE C 1 86 ALA N 1 86 ALA CA 1 86 ALA C -85.20 -45.20 -64.41 -72.40 -54.86 . . 0 "[ . 1 . 2 . 3]"
106 . 1 86 ALA N 1 86 ALA CA 1 86 ALA C 1 87 ARG N -55.70 -15.70 -42.51 -36.27 -38.23 . . 0 "[ . 1 . 2 . 3]"
107 . 1 86 ALA C 1 87 ARG N 1 87 ARG CA 1 87 ARG C -81.50 -41.50 -66.28 -62.36 -63.83 0.60 18 0 "[ . 1 . 2 . 3]"
108 . 1 87 ARG N 1 87 ARG CA 1 87 ARG C 1 88 ASP N -64.20 -24.20 -41.01 -53.42 -24.71 . . 0 "[ . 1 . 2 . 3]"
109 . 1 87 ARG C 1 88 ASP N 1 88 ASP CA 1 88 ASP C -87.50 -47.50 -66.08 -59.54 -62.33 . . 0 "[ . 1 . 2 . 3]"
110 . 1 88 ASP N 1 88 ASP CA 1 88 ASP C 1 89 LEU N -56.00 -16.00 -42.16 -56.69 -29.59 0.69 6 0 "[ . 1 . 2 . 3]"
111 . 1 88 ASP C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -85.70 -45.70 -68.73 -65.03 -65.82 . . 0 "[ . 1 . 2 . 3]"
112 . 1 89 LEU N 1 89 LEU CA 1 89 LEU C 1 90 ALA N -62.90 -22.90 -35.89 -37.37 -37.96 . . 0 "[ . 1 . 2 . 3]"
113 . 1 89 LEU C 1 90 ALA N 1 90 ALA CA 1 90 ALA C -81.00 -41.00 -62.79 -63.90 -64.30 . . 0 "[ . 1 . 2 . 3]"
114 . 1 90 ALA N 1 90 ALA CA 1 90 ALA C 1 91 ASP N -60.60 -20.60 -38.25 -43.34 -30.70 . . 0 "[ . 1 . 2 . 3]"
115 . 1 90 ALA C 1 91 ASP N 1 91 ASP CA 1 91 ASP C -87.60 -47.60 -66.69 -67.89 -68.27 . . 0 "[ . 1 . 2 . 3]"
116 . 1 91 ASP N 1 91 ASP CA 1 91 ASP C 1 92 TYR N -55.80 -15.80 -42.94 -41.03 -41.68 . . 0 "[ . 1 . 2 . 3]"
117 . 1 91 ASP C 1 92 TYR N 1 92 TYR CA 1 92 TYR C -103.60 -37.40 -56.85 -57.18 -57.42 . . 0 "[ . 1 . 2 . 3]"
118 . 1 92 TYR N 1 92 TYR CA 1 92 TYR C 1 93 ILE N -64.90 -19.30 -51.07 -57.60 -42.78 . . 0 "[ . 1 . 2 . 3]"
119 . 1 92 TYR C 1 93 ILE N 1 93 ILE CA 1 93 ILE C -81.30 -41.30 -64.11 -70.19 -56.50 . . 0 "[ . 1 . 2 . 3]"
120 . 1 93 ILE N 1 93 ILE CA 1 93 ILE C 1 94 GLN N -64.40 -24.40 -33.64 -35.14 -35.42 . . 0 "[ . 1 . 2 . 3]"
121 . 1 93 ILE C 1 94 GLN N 1 94 GLN CA 1 94 GLN C -81.70 -41.70 -66.31 -72.24 -61.04 . . 0 "[ . 1 . 2 . 3]"
122 . 1 94 GLN N 1 94 GLN CA 1 94 GLN C 1 95 GLU N -60.90 -20.90 -40.48 -38.31 -40.93 . . 0 "[ . 1 . 2 . 3]"
123 . 1 94 GLN C 1 95 GLU N 1 95 GLU CA 1 95 GLU C -85.00 -45.00 -61.87 -68.53 -53.31 . . 0 "[ . 1 . 2 . 3]"
124 . 1 95 GLU N 1 95 GLU CA 1 95 GLU C 1 96 GLN N -50.90 -10.90 -36.17 -51.03 -21.17 0.13 27 0 "[ . 1 . 2 . 3]"
125 . 1 95 GLU C 1 96 GLN N 1 96 GLN CA 1 96 GLN C -113.30 -73.30 -81.69 -88.33 -90.99 0.31 29 0 "[ . 1 . 2 . 3]"
126 . 1 96 GLN N 1 96 GLN CA 1 96 GLN C 1 97 GLY N -13.30 26.70 -12.14 -14.36 1.47 1.06 3 0 "[ . 1 . 2 . 3]"
127 . 1 96 GLN C 1 97 GLY N 1 97 GLY CA 1 97 GLY C 57.30 123.70 82.14 82.22 80.88 . . 0 "[ . 1 . 2 . 3]"
128 . 1 97 GLY N 1 97 GLY CA 1 97 GLY C 1 98 TRP N -16.60 38.00 29.84 8.02 39.41 1.41 18 0 "[ . 1 . 2 . 3]"
129 . 1 97 GLY C 1 98 TRP N 1 98 TRP CA 1 98 TRP C -135.70 -65.70 -102.89 -117.74 -81.42 . . 0 "[ . 1 . 2 . 3]"
130 . 1 98 TRP N 1 98 TRP CA 1 98 TRP C 1 99 GLN N 89.20 -153.00 165.43 170.91 168.26 . . 0 "[ . 1 . 2 . 3]"
131 . 1 98 TRP C 1 99 GLN N 1 99 GLN CA 1 99 GLN C -159.40 -76.60 -135.09 -160.09 -112.47 0.69 6 0 "[ . 1 . 2 . 3]"
132 . 1 99 GLN N 1 99 GLN CA 1 99 GLN C 1 100 THR N 127.80 178.80 171.76 171.23 169.55 0.14 6 0 "[ . 1 . 2 . 3]"
133 . 1 99 GLN C 1 100 THR N 1 100 THR CA 1 100 THR C -175.90 -88.70 -156.87 -157.53 -158.28 . . 0 "[ . 1 . 2 . 3]"
134 . 1 100 THR N 1 100 THR CA 1 100 THR C 1 101 TYR N 131.00 -177.00 171.34 153.51 -177.33 . . 0 "[ . 1 . 2 . 3]"
135 . 1 100 THR C 1 101 TYR N 1 101 TYR CA 1 101 TYR C 178.80 -72.40 -109.94 -125.06 -130.81 . . 0 "[ . 1 . 2 . 3]"
136 . 1 101 TYR N 1 101 TYR CA 1 101 TYR C 1 102 GLY N 121.30 162.90 120.55 117.48 128.73 3.82 30 0 "[ . 1 . 2 . 3]"
137 . 1 101 TYR C 1 102 GLY N 1 102 GLY CA 1 102 GLY C 109.50 -110.50 108.74 109.24 109.04 3.72 17 0 "[ . 1 . 2 . 3]"
138 . 1 102 GLY N 1 102 GLY CA 1 102 GLY C 1 103 ASP N 138.80 -150.40 -152.55 -149.49 -149.64 1.30 5 0 "[ . 1 . 2 . 3]"
139 . 1 102 GLY C 1 103 ASP N 1 103 ASP CA 1 103 ASP C -142.90 -2.90 -119.09 -112.52 -116.04 . . 0 "[ . 1 . 2 . 3]"
140 . 1 103 ASP N 1 103 ASP CA 1 103 ASP C 1 104 VAL N 70.40 -149.60 150.01 147.19 146.03 . . 0 "[ . 1 . 2 . 3]"
141 . 1 103 ASP C 1 104 VAL N 1 104 VAL CA 1 104 VAL C -129.60 -52.80 -77.52 -89.39 -66.05 . . 0 "[ . 1 . 2 . 3]"
142 . 1 104 VAL N 1 104 VAL CA 1 104 VAL C 1 105 VAL N 104.30 148.10 121.02 131.99 128.10 0.71 23 0 "[ . 1 . 2 . 3]"
143 . 1 104 VAL C 1 105 VAL N 1 105 VAL CA 1 105 VAL C -139.30 -95.10 -126.83 -139.61 -106.15 0.31 15 0 "[ . 1 . 2 . 3]"
144 . 1 105 VAL N 1 105 VAL CA 1 105 VAL C 1 106 VAL N 121.00 169.00 125.37 120.00 149.65 1.00 30 0 "[ . 1 . 2 . 3]"
145 . 1 105 VAL C 1 106 VAL N 1 106 VAL CA 1 106 VAL C -145.20 -105.20 -115.25 -137.33 -104.43 0.77 16 0 "[ . 1 . 2 . 3]"
146 . 1 106 VAL N 1 106 VAL CA 1 106 VAL C 1 107 ARG N 112.80 152.80 131.64 132.35 129.82 0.37 29 0 "[ . 1 . 2 . 3]"
147 . 1 106 VAL C 1 107 ARG N 1 107 ARG CA 1 107 ARG C -153.50 -106.10 -125.54 -150.56 -105.78 0.32 16 0 "[ . 1 . 2 . 3]"
148 . 1 107 ARG N 1 107 ARG CA 1 107 ARG C 1 108 PHE N 126.10 173.50 138.84 130.51 127.17 0.70 4 0 "[ . 1 . 2 . 3]"
149 . 1 107 ARG C 1 108 PHE N 1 108 PHE CA 1 108 PHE C -154.30 -90.90 -109.38 -101.11 -104.00 . . 0 "[ . 1 . 2 . 3]"
150 . 1 108 PHE N 1 108 PHE CA 1 108 PHE C 1 109 GLU N 114.70 161.10 128.59 114.23 151.27 0.47 19 0 "[ . 1 . 2 . 3]"
151 . 1 108 PHE C 1 109 GLU N 1 109 GLU CA 1 109 GLU C -166.30 -118.10 -139.03 -142.93 -145.28 1.11 9 0 "[ . 1 . 2 . 3]"
152 . 1 109 GLU N 1 109 GLU CA 1 109 GLU C 1 110 GLN N 120.00 175.60 168.21 164.80 164.16 0.93 14 0 "[ . 1 . 2 . 3]"
153 . 1 109 GLU C 1 110 GLN N 1 110 GLN CA 1 110 GLN C -143.90 -89.30 -111.54 -110.18 -113.03 . . 0 "[ . 1 . 2 . 3]"
154 . 1 110 GLN N 1 110 GLN CA 1 110 GLN C 1 111 SER N 112.80 164.20 157.71 163.52 160.87 1.39 19 0 "[ . 1 . 2 . 3]"
155 . 1 110 GLN C 1 111 SER N 1 111 SER CA 1 111 SER C -165.30 -33.90 -141.27 -154.17 -119.19 . . 0 "[ . 1 . 2 . 3]"
156 . 1 111 SER N 1 111 SER CA 1 111 SER C 1 112 SER N 102.90 169.10 132.39 101.77 150.21 1.13 28 0 "[ . 1 . 2 . 3]"
157 . 1 111 SER C 1 112 SER N 1 112 SER CA 1 112 SER C -80.50 -40.50 -76.91 -59.94 -64.67 2.43 15 0 "[ . 1 . 2 . 3]"
158 . 1 112 SER N 1 112 SER CA 1 112 SER C 1 113 ASN N -42.90 -2.90 -19.85 -40.47 -2.81 0.09 16 0 "[ . 1 . 2 . 3]"
159 . 1 112 SER C 1 113 ASN N 1 113 ASN CA 1 113 ASN C -125.80 -66.00 -77.94 -88.87 -65.61 0.39 3 0 "[ . 1 . 2 . 3]"
160 . 1 113 ASN N 1 113 ASN CA 1 113 ASN C 1 114 LEU N -66.70 42.30 -24.00 -46.34 3.19 . . 0 "[ . 1 . 2 . 3]"
161 . 1 113 ASN C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -177.10 -37.10 -90.71 -97.52 -101.24 . . 0 "[ . 1 . 2 . 3]"
162 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C 1 115 HIS N 83.70 -165.30 141.16 140.47 137.37 . . 0 "[ . 1 . 2 . 3]"
163 . 1 114 LEU C 1 115 HIS N 1 115 HIS CA 1 115 HIS C -152.60 -77.00 -103.68 -148.20 -76.55 0.45 23 0 "[ . 1 . 2 . 3]"
164 . 1 115 HIS N 1 115 HIS CA 1 115 HIS C 1 116 THR N 131.80 171.80 162.05 144.22 173.54 1.74 18 0 "[ . 1 . 2 . 3]"
165 . 1 115 HIS C 1 116 THR N 1 116 THR CA 1 116 THR C -101.30 -36.10 -58.35 -62.23 -64.59 0.27 15 0 "[ . 1 . 2 . 3]"
166 . 1 116 THR N 1 116 THR CA 1 116 THR C 1 117 GLY N 110.90 150.90 125.81 110.55 145.31 0.35 6 0 "[ . 1 . 2 . 3]"
167 . 1 117 GLY C 1 118 GLN N 1 118 GLN CA 1 118 GLN C -174.60 -55.00 -111.21 -107.20 -112.17 . . 0 "[ . 1 . 2 . 3]"
168 . 1 118 GLN N 1 118 GLN CA 1 118 GLN C 1 119 PHE N 95.70 -157.70 137.68 104.73 169.09 . . 0 "[ . 1 . 2 . 3]"
169 . 1 118 GLN C 1 119 PHE N 1 119 PHE CA 1 119 PHE C -174.40 -90.80 -146.39 -149.66 -152.06 1.71 6 0 "[ . 1 . 2 . 3]"
170 . 1 119 PHE N 1 119 PHE CA 1 119 PHE C 1 120 ARG N 134.70 174.70 154.14 156.63 154.49 . . 0 "[ . 1 . 2 . 3]"
171 . 1 119 PHE C 1 120 ARG N 1 120 ARG CA 1 120 ARG C -171.70 -101.50 -136.57 -141.29 -141.96 . . 0 "[ . 1 . 2 . 3]"
172 . 1 120 ARG N 1 120 ARG CA 1 120 ARG C 1 121 ALA N 131.00 173.60 142.08 143.12 139.35 0.70 1 0 "[ . 1 . 2 . 3]"
173 . 1 120 ARG C 1 121 ALA N 1 121 ALA CA 1 121 ALA C -168.70 -113.70 -134.04 -118.90 -120.04 0.38 5 0 "[ . 1 . 2 . 3]"
174 . 1 121 ALA N 1 121 ALA CA 1 121 ALA C 1 122 ARG N 119.70 -179.50 129.93 125.34 122.95 1.67 20 0 "[ . 1 . 2 . 3]"
175 . 1 121 ALA C 1 122 ARG N 1 122 ARG CA 1 122 ARG C -179.30 -112.50 -130.13 -156.90 -111.87 0.63 11 0 "[ . 1 . 2 . 3]"
176 . 1 122 ARG N 1 122 ARG CA 1 122 ARG C 1 123 GLY N 115.40 179.80 132.85 115.24 162.36 0.16 2 0 "[ . 1 . 2 . 3]"
177 . 1 122 ARG C 1 123 GLY N 1 123 GLY CA 1 123 GLY C 160.20 -59.80 -113.45 -107.10 -110.74 . . 0 "[ . 1 . 2 . 3]"
178 . 1 123 GLY N 1 123 GLY CA 1 123 GLY C 1 124 THR N 81.10 -138.90 123.06 98.26 155.48 . . 0 "[ . 1 . 2 . 3]"
179 . 1 123 GLY C 1 124 THR N 1 124 THR CA 1 124 THR C -156.60 -82.80 -126.85 -143.13 -144.85 . . 0 "[ . 1 . 2 . 3]"
180 . 1 124 THR N 1 124 THR CA 1 124 THR C 1 125 VAL N 94.90 178.90 152.10 137.84 173.00 . . 0 "[ . 1 . 2 . 3]"
181 . 1 124 THR C 1 125 VAL N 1 125 VAL CA 1 125 VAL C -127.10 -52.10 -93.27 -105.95 -79.35 . . 0 "[ . 1 . 2 . 3]"
182 . 1 125 VAL N 1 125 VAL CA 1 125 VAL C 1 126 ASN N 104.10 158.50 111.53 127.85 120.55 0.44 6 0 "[ . 1 . 2 . 3]"
183 . 1 125 VAL C 1 126 ASN N 1 126 ASN CA 1 126 ASN C -165.40 -56.20 -113.60 -135.48 -88.35 . . 0 "[ . 1 . 2 . 3]"
184 . 1 126 ASN N 1 126 ASN CA 1 126 ASN C 1 127 PRO N 73.00 -177.40 100.60 86.99 130.80 . . 0 "[ . 1 . 2 . 3]"
185 . 1 128 ASP C 1 129 VAL N 1 129 VAL CA 1 129 VAL C 167.80 -52.20 -112.14 -144.71 -64.16 . . 0 "[ . 1 . 2 . 3]"
186 . 1 129 VAL N 1 129 VAL CA 1 129 VAL C 1 130 GLU N 89.50 -176.50 116.64 126.79 123.81 . . 0 "[ . 1 . 2 . 3]"
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