NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
644645 |
6sgo   |
34423 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_6sgo
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 214
_TA_constraint_stats_list.Viol_count 445
_TA_constraint_stats_list.Viol_total 7564.26
_TA_constraint_stats_list.Viol_max 4.46
_TA_constraint_stats_list.Viol_rms 0.35
_TA_constraint_stats_list.Viol_average_all_restraints 0.09
_TA_constraint_stats_list.Viol_average_violations_only 0.85
_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 18 ASP C 1 19 LEU N 1 19 LEU CA 1 19 LEU C -81.70 -41.70 -67.44 -72.36 -62.96 . . 0 "[ . 1 . 2]"
2 . 1 19 LEU N 1 19 LEU CA 1 19 LEU C 1 20 ASP N -59.20 -19.20 -37.85 -37.34 -38.13 . . 0 "[ . 1 . 2]"
3 . 1 19 LEU C 1 20 ASP N 1 20 ASP CA 1 20 ASP C -84.40 -44.40 -66.77 -67.96 -68.71 . . 0 "[ . 1 . 2]"
4 . 1 20 ASP N 1 20 ASP CA 1 20 ASP C 1 21 VAL N -59.60 -19.60 -44.23 -53.45 -31.35 . . 0 "[ . 1 . 2]"
5 . 1 20 ASP C 1 21 VAL N 1 21 VAL CA 1 21 VAL C -86.10 -46.10 -66.51 -74.46 -58.32 . . 0 "[ . 1 . 2]"
6 . 1 21 VAL N 1 21 VAL CA 1 21 VAL C 1 22 LYS N -64.70 -24.70 -43.69 -50.19 -53.89 . . 0 "[ . 1 . 2]"
7 . 1 21 VAL C 1 22 LYS N 1 22 LYS CA 1 22 LYS C -80.90 -40.90 -71.74 -77.78 -64.14 . . 0 "[ . 1 . 2]"
8 . 1 22 LYS N 1 22 LYS CA 1 22 LYS C 1 23 GLY N -65.10 -25.10 -29.26 -35.47 -24.51 0.59 8 0 "[ . 1 . 2]"
9 . 1 22 LYS C 1 23 GLY N 1 23 GLY CA 1 23 GLY C -82.20 -42.20 -68.92 -73.03 -62.22 . . 0 "[ . 1 . 2]"
10 . 1 23 GLY N 1 23 GLY CA 1 23 GLY C 1 24 LEU N -62.50 -22.50 -46.61 -57.74 -37.13 . . 0 "[ . 1 . 2]"
11 . 1 23 GLY C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -81.00 -41.00 -67.57 -71.46 -62.89 . . 0 "[ . 1 . 2]"
12 . 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 GLY N -62.80 -22.80 -43.04 -38.98 -46.48 . . 0 "[ . 1 . 2]"
13 . 1 24 LEU C 1 25 GLY N 1 25 GLY CA 1 25 GLY C -82.10 -42.10 -61.83 -68.14 -56.19 . . 0 "[ . 1 . 2]"
14 . 1 25 GLY N 1 25 GLY CA 1 25 GLY C 1 26 TYR N -62.30 -22.30 -41.88 -43.67 -44.30 . . 0 "[ . 1 . 2]"
15 . 1 25 GLY C 1 26 TYR N 1 26 TYR CA 1 26 TYR C -84.10 -44.10 -67.99 -65.32 -66.17 . . 0 "[ . 1 . 2]"
16 . 1 26 TYR N 1 26 TYR CA 1 26 TYR C 1 27 ASP N -60.80 -20.80 -42.25 -47.56 -32.52 . . 0 "[ . 1 . 2]"
17 . 1 26 TYR C 1 27 ASP N 1 27 ASP CA 1 27 ASP C -85.70 -45.70 -62.65 -66.18 -57.75 . . 0 "[ . 1 . 2]"
18 . 1 27 ASP N 1 27 ASP CA 1 27 ASP C 1 28 PHE N -55.60 -11.20 -42.61 -38.63 -39.32 . . 0 "[ . 1 . 2]"
19 . 1 27 ASP C 1 28 PHE N 1 28 PHE CA 1 28 PHE C -102.10 -62.10 -62.35 -64.63 -61.31 0.79 19 0 "[ . 1 . 2]"
20 . 1 28 PHE N 1 28 PHE CA 1 28 PHE C 1 29 ILE N -54.50 -4.30 -53.90 -55.32 -51.59 0.82 20 0 "[ . 1 . 2]"
21 . 1 29 ILE C 1 30 ASP N 1 30 ASP CA 1 30 ASP C -80.10 -40.10 -64.65 -70.83 -58.73 . . 0 "[ . 1 . 2]"
22 . 1 30 ASP N 1 30 ASP CA 1 30 ASP C 1 31 LEU N -60.20 -20.20 -46.66 -49.76 -52.12 . . 0 "[ . 1 . 2]"
23 . 1 30 ASP C 1 31 LEU N 1 31 LEU CA 1 31 LEU C -86.80 -46.80 -69.75 -73.59 -67.60 . . 0 "[ . 1 . 2]"
24 . 1 31 LEU N 1 31 LEU CA 1 31 LEU C 1 32 VAL N -52.80 -12.80 -27.81 -31.22 -19.13 . . 0 "[ . 1 . 2]"
25 . 1 31 LEU C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -91.00 -44.00 -70.97 -74.86 -67.17 . . 0 "[ . 1 . 2]"
26 . 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 THR N -54.50 -2.10 -25.30 -28.54 -31.84 . . 0 "[ . 1 . 2]"
27 . 1 32 VAL C 1 33 THR N 1 33 THR CA 1 33 THR C -137.60 -78.20 -110.81 -119.77 -106.13 . . 0 "[ . 1 . 2]"
28 . 1 33 THR N 1 33 THR CA 1 33 THR C 1 34 LYS N -28.80 31.40 17.99 9.83 28.16 . . 0 "[ . 1 . 2]"
29 . 1 33 THR C 1 34 LYS N 1 34 LYS CA 1 34 LYS C -165.30 -25.30 -60.83 -63.40 -69.63 . . 0 "[ . 1 . 2]"
30 . 1 34 LYS N 1 34 LYS CA 1 34 LYS C 1 35 SER N 111.60 178.60 147.86 124.25 171.26 . . 0 "[ . 1 . 2]"
31 . 1 34 LYS C 1 35 SER N 1 35 SER CA 1 35 SER C -110.90 -36.70 -57.03 -74.67 -40.72 . . 0 "[ . 1 . 2]"
32 . 1 35 SER N 1 35 SER CA 1 35 SER C 1 36 PRO N 113.30 170.10 150.00 153.91 150.39 . . 0 "[ . 1 . 2]"
33 . 1 35 SER C 1 36 PRO N 1 36 PRO CA 1 36 PRO C -83.40 -37.60 -63.00 -69.31 -78.16 . . 0 "[ . 1 . 2]"
34 . 1 36 PRO N 1 36 PRO CA 1 36 PRO C 1 37 ASP N -47.80 -7.80 -8.41 -6.49 -6.83 2.63 11 0 "[ . 1 . 2]"
35 . 1 36 PRO C 1 37 ASP N 1 37 ASP CA 1 37 ASP C -119.50 -55.10 -64.19 -65.80 -66.21 0.79 11 0 "[ . 1 . 2]"
36 . 1 37 ASP N 1 37 ASP CA 1 37 ASP C 1 38 SER N -26.00 22.40 -26.77 -27.84 -27.94 2.02 1 0 "[ . 1 . 2]"
37 . 1 38 SER C 1 39 VAL N 1 39 VAL CA 1 39 VAL C -81.20 -41.20 -60.76 -81.21 -49.61 0.01 13 0 "[ . 1 . 2]"
38 . 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 40 ASN N -52.50 -3.30 -45.78 -37.88 -41.63 2.45 9 0 "[ . 1 . 2]"
39 . 1 40 ASN C 1 41 SER N 1 41 SER CA 1 41 SER C -82.70 -42.70 -63.48 -64.13 -65.89 . . 0 "[ . 1 . 2]"
40 . 1 41 SER N 1 41 SER CA 1 41 SER C 1 42 GLU N -60.40 -20.40 -33.62 -42.94 -23.67 . . 0 "[ . 1 . 2]"
41 . 1 41 SER C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -83.50 -43.50 -67.09 -73.83 -61.38 . . 0 "[ . 1 . 2]"
42 . 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 HIS N -61.20 -21.20 -21.97 -21.73 -22.75 1.17 17 0 "[ . 1 . 2]"
43 . 1 42 GLU C 1 43 HIS N 1 43 HIS CA 1 43 HIS C -80.80 -40.80 -69.46 -68.69 -69.76 . . 0 "[ . 1 . 2]"
44 . 1 43 HIS N 1 43 HIS CA 1 43 HIS C 1 44 GLU N -63.40 -23.40 -45.40 -49.87 -38.46 . . 0 "[ . 1 . 2]"
45 . 1 43 HIS C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -87.30 -47.30 -68.38 -66.99 -67.57 . . 0 "[ . 1 . 2]"
46 . 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 LEU N -57.60 -17.60 -33.38 -38.24 -26.82 . . 0 "[ . 1 . 2]"
47 . 1 44 GLU C 1 45 LEU N 1 45 LEU CA 1 45 LEU C -86.20 -46.20 -67.20 -67.10 -67.78 . . 0 "[ . 1 . 2]"
48 . 1 45 LEU N 1 45 LEU CA 1 45 LEU C 1 46 ALA N -59.70 -19.70 -44.15 -47.08 -40.83 . . 0 "[ . 1 . 2]"
49 . 1 45 LEU C 1 46 ALA N 1 46 ALA CA 1 46 ALA C -82.30 -42.30 -61.97 -64.13 -59.51 . . 0 "[ . 1 . 2]"
50 . 1 46 ALA N 1 46 ALA CA 1 46 ALA C 1 47 HIS N -58.80 -18.80 -33.94 -35.90 -36.62 . . 0 "[ . 1 . 2]"
51 . 1 46 ALA C 1 47 HIS N 1 47 HIS CA 1 47 HIS C -85.60 -45.60 -72.69 -77.12 -68.47 . . 0 "[ . 1 . 2]"
52 . 1 47 HIS N 1 47 HIS CA 1 47 HIS C 1 48 PHE N -60.40 -20.40 -36.05 -40.52 -27.72 . . 0 "[ . 1 . 2]"
53 . 1 47 HIS C 1 48 PHE N 1 48 PHE CA 1 48 PHE C -87.80 -46.00 -68.84 -70.31 -74.72 . . 0 "[ . 1 . 2]"
54 . 1 48 PHE N 1 48 PHE CA 1 48 PHE C 1 49 LEU N -65.40 -25.40 -43.66 -43.24 -44.29 . . 0 "[ . 1 . 2]"
55 . 1 49 LEU C 1 50 GLY N 1 50 GLY CA 1 50 GLY C -108.20 -22.20 -46.78 -54.32 -38.47 . . 0 "[ . 1 . 2]"
56 . 1 50 GLY N 1 50 GLY CA 1 50 GLY C 1 51 PRO N -67.30 -14.90 -60.09 -58.21 -60.19 0.14 8 0 "[ . 1 . 2]"
57 . 1 50 GLY C 1 51 PRO N 1 51 PRO CA 1 51 PRO C -84.90 -41.70 -80.06 -76.85 -76.98 0.89 12 0 "[ . 1 . 2]"
58 . 1 51 PRO N 1 51 PRO CA 1 51 PRO C 1 52 HIS N -48.00 -6.60 -5.55 -4.10 -4.92 3.25 12 0 "[ . 1 . 2]"
59 . 1 52 HIS C 1 53 ASP N 1 53 ASP CA 1 53 ASP C -167.30 -56.90 -56.73 -54.97 -55.70 4.46 19 0 "[ . 1 . 2]"
60 . 1 53 ASP N 1 53 ASP CA 1 53 ASP C 1 54 PRO N 28.50 168.50 108.28 98.58 120.07 . . 0 "[ . 1 . 2]"
61 . 1 54 PRO C 1 55 GLU N 1 55 GLU CA 1 55 GLU C -166.90 -39.30 -90.00 -81.99 -84.22 . . 0 "[ . 1 . 2]"
62 . 1 55 GLU N 1 55 GLU CA 1 55 GLU C 1 56 ILE N 75.00 -174.60 119.08 104.74 101.98 . . 0 "[ . 1 . 2]"
63 . 1 55 GLU C 1 56 ILE N 1 56 ILE CA 1 56 ILE C -139.60 -73.00 -102.28 -116.48 -87.15 . . 0 "[ . 1 . 2]"
64 . 1 56 ILE N 1 56 ILE CA 1 56 ILE C 1 57 TYR N 105.70 145.70 110.05 106.54 105.95 0.01 1 0 "[ . 1 . 2]"
65 . 1 56 ILE C 1 57 TYR N 1 57 TYR CA 1 57 TYR C -153.70 -84.90 -95.97 -100.34 -89.84 . . 0 "[ . 1 . 2]"
66 . 1 57 TYR N 1 57 TYR CA 1 57 TYR C 1 58 VAL N 99.40 -177.40 126.33 112.37 109.57 . . 0 "[ . 1 . 2]"
67 . 1 57 TYR C 1 58 VAL N 1 58 VAL CA 1 58 VAL C -169.40 -109.00 -123.45 -133.54 -107.97 1.03 16 0 "[ . 1 . 2]"
68 . 1 58 VAL N 1 58 VAL CA 1 58 VAL C 1 59 ASN N 103.70 144.90 116.27 116.93 114.68 . . 0 "[ . 1 . 2]"
69 . 1 58 VAL C 1 59 ASN N 1 59 ASN CA 1 59 ASN C 33.00 73.00 62.23 56.63 66.13 . . 0 "[ . 1 . 2]"
70 . 1 59 ASN N 1 59 ASN CA 1 59 ASN C 1 60 GLY N 21.20 61.20 21.75 19.61 29.44 1.59 12 0 "[ . 1 . 2]"
71 . 1 59 ASN C 1 60 GLY N 1 60 GLY CA 1 60 GLY C 59.10 99.10 95.16 99.53 99.47 0.53 11 0 "[ . 1 . 2]"
72 . 1 60 GLY N 1 60 GLY CA 1 60 GLY C 1 61 LYS N -25.50 28.90 2.05 5.94 4.72 . . 0 "[ . 1 . 2]"
73 . 1 60 GLY C 1 61 LYS N 1 61 LYS CA 1 61 LYS C -133.10 -75.50 -106.78 -116.64 -93.59 . . 0 "[ . 1 . 2]"
74 . 1 61 LYS N 1 61 LYS CA 1 61 LYS C 1 62 ILE N 109.90 151.10 132.46 125.68 139.94 . . 0 "[ . 1 . 2]"
75 . 1 61 LYS C 1 62 ILE N 1 62 ILE CA 1 62 ILE C -130.30 -67.70 -74.88 -78.88 -68.51 . . 0 "[ . 1 . 2]"
76 . 1 62 ILE N 1 62 ILE CA 1 62 ILE C 1 63 GLN N 97.90 152.90 126.52 127.05 126.52 . . 0 "[ . 1 . 2]"
77 . 1 62 ILE C 1 63 GLN N 1 63 GLN CA 1 63 GLN C -171.10 -87.50 -123.36 -128.41 -115.22 . . 0 "[ . 1 . 2]"
78 . 1 63 GLN N 1 63 GLN CA 1 63 GLN C 1 64 THR N 137.20 177.20 146.07 150.94 150.12 0.24 5 0 "[ . 1 . 2]"
79 . 1 63 GLN C 1 64 THR N 1 64 THR CA 1 64 THR C -123.70 -43.90 -90.74 -95.14 -97.71 . . 0 "[ . 1 . 2]"
80 . 1 64 THR N 1 64 THR CA 1 64 THR C 1 65 THR N 144.50 -175.50 172.87 168.21 175.71 . . 0 "[ . 1 . 2]"
81 . 1 64 THR C 1 65 THR N 1 65 THR CA 1 65 THR C -80.20 -40.20 -54.90 -65.64 -42.25 . . 0 "[ . 1 . 2]"
82 . 1 65 THR N 1 65 THR CA 1 65 THR C 1 66 THR N -59.70 -19.70 -36.63 -40.67 -42.89 . . 0 "[ . 1 . 2]"
83 . 1 65 THR C 1 66 THR N 1 66 THR CA 1 66 THR C -85.10 -45.10 -63.78 -67.21 -69.35 . . 0 "[ . 1 . 2]"
84 . 1 66 THR N 1 66 THR CA 1 66 THR C 1 67 ALA N -58.70 -18.70 -47.87 -56.00 -40.57 . . 0 "[ . 1 . 2]"
85 . 1 66 THR C 1 67 ALA N 1 67 ALA CA 1 67 ALA C -82.20 -42.20 -62.69 -64.51 -64.86 . . 0 "[ . 1 . 2]"
86 . 1 67 ALA N 1 67 ALA CA 1 67 ALA C 1 68 PHE N -63.70 -23.70 -47.36 -51.28 -44.90 . . 0 "[ . 1 . 2]"
87 . 1 67 ALA C 1 68 PHE N 1 68 PHE CA 1 68 PHE C -85.10 -45.10 -52.98 -54.46 -49.87 . . 0 "[ . 1 . 2]"
88 . 1 68 PHE N 1 68 PHE CA 1 68 PHE C 1 69 LEU N -64.10 -24.10 -55.30 -55.17 -55.21 . . 0 "[ . 1 . 2]"
89 . 1 68 PHE C 1 69 LEU N 1 69 LEU CA 1 69 LEU C -81.90 -41.90 -51.12 -54.16 -48.34 . . 0 "[ . 1 . 2]"
90 . 1 69 LEU N 1 69 LEU CA 1 69 LEU C 1 70 GLN N -60.40 -20.40 -43.39 -43.30 -43.80 . . 0 "[ . 1 . 2]"
91 . 1 69 LEU C 1 70 GLN N 1 70 GLN CA 1 70 GLN C -84.70 -44.70 -60.39 -63.81 -55.54 . . 0 "[ . 1 . 2]"
92 . 1 70 GLN N 1 70 GLN CA 1 70 GLN C 1 71 PHE N -59.50 -19.50 -49.32 -53.61 -46.49 . . 0 "[ . 1 . 2]"
93 . 1 70 GLN C 1 71 PHE N 1 71 PHE CA 1 71 PHE C -87.40 -47.40 -65.98 -67.22 -68.40 . . 0 "[ . 1 . 2]"
94 . 1 71 PHE N 1 71 PHE CA 1 71 PHE C 1 72 PHE N -57.10 -17.10 -35.66 -34.13 -35.28 . . 0 "[ . 1 . 2]"
95 . 1 71 PHE C 1 72 PHE N 1 72 PHE CA 1 72 PHE C -85.30 -45.30 -59.09 -57.86 -57.99 . . 0 "[ . 1 . 2]"
96 . 1 72 PHE N 1 72 PHE CA 1 72 PHE C 1 73 ARG N -58.50 -18.50 -53.47 -56.02 -51.31 . . 0 "[ . 1 . 2]"
97 . 1 72 PHE C 1 73 ARG N 1 73 ARG CA 1 73 ARG C -84.40 -44.40 -70.99 -75.33 -66.07 . . 0 "[ . 1 . 2]"
98 . 1 73 ARG N 1 73 ARG CA 1 73 ARG C 1 74 GLN N -51.20 -1.20 -22.06 -24.50 -29.67 . . 0 "[ . 1 . 2]"
99 . 1 73 ARG C 1 74 GLN N 1 74 GLN CA 1 74 GLN C -107.50 -67.50 -78.69 -87.80 -71.39 . . 0 "[ . 1 . 2]"
100 . 1 74 GLN N 1 74 GLN CA 1 74 GLN C 1 75 GLY N -19.80 20.20 -10.66 -8.25 -8.78 0.32 17 0 "[ . 1 . 2]"
101 . 1 75 GLY C 1 76 LEU N 1 76 LEU CA 1 76 LEU C -93.10 -53.10 -75.79 -88.44 -64.77 . . 0 "[ . 1 . 2]"
102 . 1 76 LEU N 1 76 LEU CA 1 76 LEU C 1 77 PHE N -60.30 -4.30 -46.14 -60.29 -28.81 . . 0 "[ . 1 . 2]"
103 . 1 76 LEU C 1 77 PHE N 1 77 PHE CA 1 77 PHE C -141.80 -49.00 -92.24 -108.08 -83.22 . . 0 "[ . 1 . 2]"
104 . 1 77 PHE N 1 77 PHE CA 1 77 PHE C 1 78 LYS N -57.00 33.40 2.56 -7.43 12.74 . . 0 "[ . 1 . 2]"
105 . 1 77 PHE C 1 78 LYS N 1 78 LYS CA 1 78 LYS C -82.50 -40.10 -68.08 -74.01 -60.19 . . 0 "[ . 1 . 2]"
106 . 1 78 LYS N 1 78 LYS CA 1 78 LYS C 1 79 LYS N -61.40 -15.00 -13.87 -10.62 -11.71 4.38 2 0 "[ . 1 . 2]"
107 . 1 78 LYS C 1 79 LYS N 1 79 LYS CA 1 79 LYS C -87.20 -47.20 -81.37 -89.53 -69.22 2.33 9 0 "[ . 1 . 2]"
108 . 1 79 LYS N 1 79 LYS CA 1 79 LYS C 1 80 LEU N -51.50 -11.50 -17.24 -11.28 -12.91 1.90 12 0 "[ . 1 . 2]"
109 . 1 79 LYS C 1 80 LEU N 1 80 LEU CA 1 80 LEU C -124.40 -56.20 -74.85 -89.32 -59.32 . . 0 "[ . 1 . 2]"
110 . 1 80 LEU N 1 80 LEU CA 1 80 LEU C 1 81 LYS N -28.60 11.40 -16.40 -17.51 -25.60 0.99 17 0 "[ . 1 . 2]"
111 . 1 80 LEU C 1 81 LYS N 1 81 LYS CA 1 81 LYS C -102.10 -39.50 -66.25 -77.47 -99.13 . . 0 "[ . 1 . 2]"
112 . 1 81 LYS N 1 81 LYS CA 1 81 LYS C 1 82 ASP N -77.50 28.10 -21.06 -41.74 4.57 . . 0 "[ . 1 . 2]"
113 . 1 81 LYS C 1 82 ASP N 1 82 ASP CA 1 82 ASP C -104.70 -55.30 -98.37 -101.13 -104.64 1.15 1 0 "[ . 1 . 2]"
114 . 1 82 ASP N 1 82 ASP CA 1 82 ASP C 1 83 ALA N -63.30 13.50 8.93 13.15 11.94 1.11 18 0 "[ . 1 . 2]"
115 . 1 83 ALA C 1 84 GLU N 1 84 GLU CA 1 84 GLU C -178.40 -38.40 -100.58 -114.41 -86.61 . . 0 "[ . 1 . 2]"
116 . 1 84 GLU N 1 84 GLU CA 1 84 GLU C 1 85 PHE N 87.90 -154.50 136.32 116.14 156.72 . . 0 "[ . 1 . 2]"
117 . 1 84 GLU C 1 85 PHE N 1 85 PHE CA 1 85 PHE C -152.80 -46.80 -91.41 -89.38 -95.25 . . 0 "[ . 1 . 2]"
118 . 1 85 PHE N 1 85 PHE CA 1 85 PHE C 1 86 ALA N 104.60 167.60 135.26 106.04 158.80 . . 0 "[ . 1 . 2]"
119 . 1 96 GLY C 1 97 GLU N 1 97 GLU CA 1 97 GLU C 179.10 -59.50 -92.69 -167.13 -58.67 0.83 15 0 "[ . 1 . 2]"
120 . 1 97 GLU N 1 97 GLU CA 1 97 GLU C 1 98 GLY N 120.00 176.80 146.76 118.54 177.40 1.46 17 0 "[ . 1 . 2]"
121 . 1 97 GLU C 1 98 GLY N 1 98 GLY CA 1 98 GLY C 140.70 -79.30 -129.21 -120.74 -133.91 . . 0 "[ . 1 . 2]"
122 . 1 98 GLY N 1 98 GLY CA 1 98 GLY C 1 99 TYR N 138.90 -165.30 148.89 137.12 -164.64 1.78 5 0 "[ . 1 . 2]"
123 . 1 98 GLY C 1 99 TYR N 1 99 TYR CA 1 99 TYR C -152.40 -107.40 -113.66 -116.70 -120.06 1.06 18 0 "[ . 1 . 2]"
124 . 1 99 TYR N 1 99 TYR CA 1 99 TYR C 1 100 LYS N 113.80 -172.20 138.19 145.32 143.63 . . 0 "[ . 1 . 2]"
125 . 1 99 TYR C 1 100 LYS N 1 100 LYS CA 1 100 LYS C -171.80 -84.60 -124.98 -126.67 -131.59 . . 0 "[ . 1 . 2]"
126 . 1 100 LYS N 1 100 LYS CA 1 100 LYS C 1 101 LEU N 99.10 153.30 103.60 97.59 129.79 1.51 2 0 "[ . 1 . 2]"
127 . 1 100 LYS C 1 101 LEU N 1 101 LEU CA 1 101 LEU C -143.10 -68.90 -106.64 -126.79 -86.88 . . 0 "[ . 1 . 2]"
128 . 1 101 LEU N 1 101 LEU CA 1 101 LEU C 1 102 VAL N 93.60 158.80 127.31 100.82 158.88 0.08 7 0 "[ . 1 . 2]"
129 . 1 101 LEU C 1 102 VAL N 1 102 VAL CA 1 102 VAL C -141.30 -99.70 -122.29 -115.89 -116.81 . . 0 "[ . 1 . 2]"
130 . 1 102 VAL N 1 102 VAL CA 1 102 VAL C 1 103 TRP N 112.80 174.60 132.80 122.18 150.24 . . 0 "[ . 1 . 2]"
131 . 1 102 VAL C 1 103 TRP N 1 103 TRP CA 1 103 TRP C -148.10 -74.10 -110.25 -132.35 -96.07 . . 0 "[ . 1 . 2]"
132 . 1 103 TRP N 1 103 TRP CA 1 103 TRP C 1 104 LYS N 127.90 167.90 142.21 147.23 145.15 0.46 11 0 "[ . 1 . 2]"
133 . 1 103 TRP C 1 104 LYS N 1 104 LYS CA 1 104 LYS C -161.90 -104.90 -119.84 -135.79 -105.90 . . 0 "[ . 1 . 2]"
134 . 1 104 LYS N 1 104 LYS CA 1 104 LYS C 1 105 SER N 121.40 161.40 125.40 123.66 121.37 1.28 11 0 "[ . 1 . 2]"
135 . 1 104 LYS C 1 105 SER N 1 105 SER CA 1 105 SER C -136.60 -37.60 -75.56 -85.82 -64.18 . . 0 "[ . 1 . 2]"
136 . 1 105 SER N 1 105 SER CA 1 105 SER C 1 106 ALA N 98.30 -154.50 -179.64 165.56 150.71 . . 0 "[ . 1 . 2]"
137 . 1 105 SER C 1 106 ALA N 1 106 ALA CA 1 106 ALA C -103.70 -56.90 -63.65 -81.62 -55.39 1.51 1 0 "[ . 1 . 2]"
138 . 1 106 ALA N 1 106 ALA CA 1 106 ALA C 1 107 ALA N 111.20 166.80 137.87 117.33 167.43 0.63 12 0 "[ . 1 . 2]"
139 . 1 106 ALA C 1 107 ALA N 1 107 ALA CA 1 107 ALA C -158.30 -18.30 -80.28 -101.96 -62.26 . . 0 "[ . 1 . 2]"
140 . 1 107 ALA N 1 107 ALA CA 1 107 ALA C 1 108 GLN N 86.40 163.80 125.56 135.12 130.89 . . 0 "[ . 1 . 2]"
141 . 1 107 ALA C 1 108 GLN N 1 108 GLN CA 1 108 GLN C -145.00 -91.60 -111.43 -139.99 -92.58 . . 0 "[ . 1 . 2]"
142 . 1 108 GLN N 1 108 GLN CA 1 108 GLN C 1 109 ARG N 100.50 172.50 130.97 101.68 150.17 . . 0 "[ . 1 . 2]"
143 . 1 108 GLN C 1 109 ARG N 1 109 ARG CA 1 109 ARG C -126.30 -60.10 -73.25 -84.60 -58.44 1.66 1 0 "[ . 1 . 2]"
144 . 1 109 ARG N 1 109 ARG CA 1 109 ARG C 1 110 SER N 102.70 158.10 126.01 130.15 120.08 0.64 11 0 "[ . 1 . 2]"
145 . 1 109 ARG C 1 110 SER N 1 110 SER CA 1 110 SER C -154.70 -51.90 -104.50 -106.79 -109.96 . . 0 "[ . 1 . 2]"
146 . 1 110 SER N 1 110 SER CA 1 110 SER C 1 111 HIS N 90.60 -165.40 158.25 105.82 -165.26 0.14 1 0 "[ . 1 . 2]"
147 . 1 110 SER C 1 111 HIS N 1 111 HIS CA 1 111 HIS C -83.50 -43.50 -71.63 -69.89 -71.83 0.92 1 0 "[ . 1 . 2]"
148 . 1 111 HIS N 1 111 HIS CA 1 111 HIS C 1 112 ASP N -61.60 11.20 -10.37 -28.13 -59.60 1.44 3 0 "[ . 1 . 2]"
149 . 1 111 HIS C 1 112 ASP N 1 112 ASP CA 1 112 ASP C -118.10 -68.50 -87.85 -81.74 -86.44 . . 0 "[ . 1 . 2]"
150 . 1 112 ASP N 1 112 ASP CA 1 112 ASP C 1 113 GLN N -4.30 35.70 7.41 -5.94 36.75 1.64 14 0 "[ . 1 . 2]"
151 . 1 112 ASP C 1 113 GLN N 1 113 GLN CA 1 113 GLN C 39.00 79.00 72.64 72.08 70.54 0.34 20 0 "[ . 1 . 2]"
152 . 1 113 GLN N 1 113 GLN CA 1 113 GLN C 1 114 LYS N 11.10 56.10 14.98 10.56 10.53 1.22 18 0 "[ . 1 . 2]"
153 . 1 114 LYS C 1 115 ILE N 1 115 ILE CA 1 115 ILE C -167.50 -89.30 -114.05 -133.14 -90.80 . . 0 "[ . 1 . 2]"
154 . 1 115 ILE N 1 115 ILE CA 1 115 ILE C 1 116 ARG N 111.90 178.10 140.15 126.16 168.55 . . 0 "[ . 1 . 2]"
155 . 1 115 ILE C 1 116 ARG N 1 116 ARG CA 1 116 ARG C 171.20 -48.80 -115.48 -133.92 -97.38 . . 0 "[ . 1 . 2]"
156 . 1 116 ARG N 1 116 ARG CA 1 116 ARG C 1 117 TRP N 80.30 -139.70 144.63 136.73 133.15 . . 0 "[ . 1 . 2]"
157 . 1 116 ARG C 1 117 TRP N 1 117 TRP CA 1 117 TRP C -167.80 -58.80 -147.21 -163.79 -121.65 . . 0 "[ . 1 . 2]"
158 . 1 117 TRP N 1 117 TRP CA 1 117 TRP C 1 118 ASP N 127.90 173.30 170.41 173.29 170.05 1.30 2 0 "[ . 1 . 2]"
159 . 1 117 TRP C 1 118 ASP N 1 118 ASP CA 1 118 ASP C -164.20 -102.80 -112.85 -116.49 -118.59 0.25 13 0 "[ . 1 . 2]"
160 . 1 118 ASP N 1 118 ASP CA 1 118 ASP C 1 119 GLU N 127.80 170.20 138.98 140.53 139.17 . . 0 "[ . 1 . 2]"
161 . 1 118 ASP C 1 119 GLU N 1 119 GLU CA 1 119 GLU C -171.10 -115.50 -116.80 -125.27 -113.78 1.72 14 0 "[ . 1 . 2]"
162 . 1 119 GLU N 1 119 GLU CA 1 119 GLU C 1 120 ALA N 133.90 178.50 148.09 147.04 145.29 . . 0 "[ . 1 . 2]"
163 . 1 119 GLU C 1 120 ALA N 1 120 ALA CA 1 120 ALA C -166.00 -110.40 -133.33 -141.61 -123.20 . . 0 "[ . 1 . 2]"
164 . 1 120 ALA N 1 120 ALA CA 1 120 ALA C 1 121 GLU N 117.90 164.10 118.36 117.75 117.55 1.19 4 0 "[ . 1 . 2]"
165 . 1 120 ALA C 1 121 GLU N 1 121 GLU CA 1 121 GLU C -142.60 -102.60 -117.46 -115.90 -116.40 . . 0 "[ . 1 . 2]"
166 . 1 121 GLU N 1 121 GLU CA 1 121 GLU C 1 122 ALA N 111.40 151.40 111.62 109.39 118.10 2.01 5 0 "[ . 1 . 2]"
167 . 1 121 GLU C 1 122 ALA N 1 122 ALA CA 1 122 ALA C -147.90 -94.90 -97.00 -95.98 -97.02 1.30 20 0 "[ . 1 . 2]"
168 . 1 122 ALA N 1 122 ALA CA 1 122 ALA C 1 123 TYR N 109.40 151.00 129.18 123.02 118.25 . . 0 "[ . 1 . 2]"
169 . 1 122 ALA C 1 123 TYR N 1 123 TYR CA 1 123 TYR C -125.00 -79.80 -110.43 -119.82 -97.84 . . 0 "[ . 1 . 2]"
170 . 1 123 TYR N 1 123 TYR CA 1 123 TYR C 1 124 ILE N 106.00 146.00 118.12 110.67 129.34 . . 0 "[ . 1 . 2]"
171 . 1 123 TYR C 1 124 ILE N 1 124 ILE CA 1 124 ILE C -138.00 -97.60 -119.48 -117.30 -118.32 . . 0 "[ . 1 . 2]"
172 . 1 124 ILE N 1 124 ILE CA 1 124 ILE C 1 125 TRP N 113.70 153.70 145.34 148.79 147.04 . . 0 "[ . 1 . 2]"
173 . 1 124 ILE C 1 125 TRP N 1 125 TRP CA 1 125 TRP C -141.10 -97.50 -129.36 -141.25 -110.89 0.15 17 0 "[ . 1 . 2]"
174 . 1 125 TRP N 1 125 TRP CA 1 125 TRP C 1 126 ARG N 110.40 150.40 147.75 140.06 152.12 1.72 17 0 "[ . 1 . 2]"
175 . 1 125 TRP C 1 126 ARG N 1 126 ARG CA 1 126 ARG C -143.80 -76.00 -90.80 -91.53 -93.00 1.19 5 0 "[ . 1 . 2]"
176 . 1 126 ARG N 1 126 ARG CA 1 126 ARG C 1 127 ARG N 101.10 150.70 119.01 100.98 150.64 0.12 2 0 "[ . 1 . 2]"
177 . 1 126 ARG C 1 127 ARG N 1 127 ARG CA 1 127 ARG C -98.90 -58.90 -78.30 -99.47 -58.44 0.57 11 0 "[ . 1 . 2]"
178 . 1 127 ARG N 1 127 ARG CA 1 127 ARG C 1 128 LYS N 133.40 -155.80 146.28 132.89 168.91 0.51 2 0 "[ . 1 . 2]"
179 . 1 127 ARG C 1 128 LYS N 1 128 LYS CA 1 128 LYS C -79.00 -39.00 -62.75 -80.97 -49.40 1.97 11 0 "[ . 1 . 2]"
180 . 1 128 LYS N 1 128 LYS CA 1 128 LYS C 1 129 ASP N -50.70 -10.70 -16.84 -12.58 -14.71 0.40 11 0 "[ . 1 . 2]"
181 . 1 128 LYS C 1 129 ASP N 1 129 ASP CA 1 129 ASP C -105.00 -65.00 -70.50 -81.06 -64.70 0.30 13 0 "[ . 1 . 2]"
182 . 1 129 ASP N 1 129 ASP CA 1 129 ASP C 1 130 GLY N -15.60 24.40 -13.88 -11.00 -13.37 2.53 14 0 "[ . 1 . 2]"
183 . 1 129 ASP C 1 130 GLY N 1 130 GLY CA 1 130 GLY C 70.30 110.30 106.10 110.29 107.92 1.78 11 0 "[ . 1 . 2]"
184 . 1 130 GLY N 1 130 GLY CA 1 130 GLY C 1 131 SER N -23.50 16.50 -14.02 -12.90 -16.66 1.75 8 0 "[ . 1 . 2]"
185 . 1 130 GLY C 1 131 SER N 1 131 SER CA 1 131 SER C -103.20 -63.20 -93.61 -105.18 -65.73 1.98 12 0 "[ . 1 . 2]"
186 . 1 131 SER N 1 131 SER CA 1 131 SER C 1 132 CYS N 71.60 -148.40 159.00 101.46 -172.34 . . 0 "[ . 1 . 2]"
187 . 1 131 SER C 1 132 CYS N 1 132 CYS CA 1 132 CYS C -169.10 -81.30 -117.66 -111.03 -119.19 0.52 9 0 "[ . 1 . 2]"
188 . 1 132 CYS N 1 132 CYS CA 1 132 CYS C 1 133 TRP N 112.40 170.40 143.48 120.74 169.40 . . 0 "[ . 1 . 2]"
189 . 1 132 CYS C 1 133 TRP N 1 133 TRP CA 1 133 TRP C -158.90 -83.90 -148.47 -159.28 -133.12 0.38 11 0 "[ . 1 . 2]"
190 . 1 133 TRP N 1 133 TRP CA 1 133 TRP C 1 134 LEU N 101.50 154.30 155.15 150.56 156.17 1.87 13 0 "[ . 1 . 2]"
191 . 1 133 TRP C 1 134 LEU N 1 134 LEU CA 1 134 LEU C -147.70 -34.50 -69.55 -76.22 -63.03 . . 0 "[ . 1 . 2]"
192 . 1 134 LEU N 1 134 LEU CA 1 134 LEU C 1 135 HIS N 78.50 156.10 123.56 122.35 119.71 . . 0 "[ . 1 . 2]"
193 . 1 134 LEU C 1 135 HIS N 1 135 HIS CA 1 135 HIS C -119.20 -56.60 -80.50 -92.42 -72.04 . . 0 "[ . 1 . 2]"
194 . 1 135 HIS N 1 135 HIS CA 1 135 HIS C 1 136 SER N -63.50 3.90 -53.53 -57.39 -59.94 . . 0 "[ . 1 . 2]"
195 . 1 135 HIS C 1 136 SER N 1 136 SER CA 1 136 SER C 166.80 -86.40 -169.74 179.52 -161.31 . . 0 "[ . 1 . 2]"
196 . 1 136 SER N 1 136 SER CA 1 136 SER C 1 137 VAL N 137.70 177.70 161.08 154.53 152.40 . . 0 "[ . 1 . 2]"
197 . 1 136 SER C 1 137 VAL N 1 137 VAL CA 1 137 VAL C -178.70 -95.50 -138.08 -144.78 -131.03 . . 0 "[ . 1 . 2]"
198 . 1 137 VAL N 1 137 VAL CA 1 137 VAL C 1 138 LYS N 115.60 -172.20 145.65 138.40 135.98 . . 0 "[ . 1 . 2]"
199 . 1 137 VAL C 1 138 LYS N 1 138 LYS CA 1 138 LYS C -171.50 -92.50 -126.00 -112.82 -114.39 . . 0 "[ . 1 . 2]"
200 . 1 138 LYS N 1 138 LYS CA 1 138 LYS C 1 139 PHE N 131.70 171.70 132.83 136.12 133.64 1.44 10 0 "[ . 1 . 2]"
201 . 1 138 LYS C 1 139 PHE N 1 139 PHE CA 1 139 PHE C -150.20 -87.00 -117.32 -125.40 -109.97 . . 0 "[ . 1 . 2]"
202 . 1 139 PHE N 1 139 PHE CA 1 139 PHE C 1 140 ILE N 107.20 147.20 127.47 112.40 143.17 . . 0 "[ . 1 . 2]"
203 . 1 139 PHE C 1 140 ILE N 1 140 ILE CA 1 140 ILE C -144.80 -68.80 -127.17 -138.25 -110.70 . . 0 "[ . 1 . 2]"
204 . 1 140 ILE N 1 140 ILE CA 1 140 ILE C 1 141 MET N 99.20 174.20 99.22 98.72 98.65 1.59 16 0 "[ . 1 . 2]"
205 . 1 140 ILE C 1 141 MET N 1 141 MET CA 1 141 MET C -154.00 -65.20 -89.79 -87.27 -87.91 . . 0 "[ . 1 . 2]"
206 . 1 141 MET N 1 141 MET CA 1 141 MET C 1 142 SER N 96.10 -174.50 123.16 136.89 133.64 3.85 13 0 "[ . 1 . 2]"
207 . 1 143 LYS C 1 144 ALA N 1 144 ALA CA 1 144 ALA C 168.90 -51.10 -143.32 -155.55 -159.52 . . 0 "[ . 1 . 2]"
208 . 1 144 ALA N 1 144 ALA CA 1 144 ALA C 1 145 ALA N 109.50 174.90 148.09 109.03 175.20 0.47 13 0 "[ . 1 . 2]"
209 . 1 144 ALA C 1 145 ALA N 1 145 ALA CA 1 145 ALA C -152.40 -66.00 -100.00 -126.69 -135.90 . . 0 "[ . 1 . 2]"
210 . 1 145 ALA N 1 145 ALA CA 1 145 ALA C 1 146 PRO N 70.50 -165.50 139.90 153.16 147.07 . . 0 "[ . 1 . 2]"
211 . 1 145 ALA C 1 146 PRO N 1 146 PRO CA 1 146 PRO C -89.80 -49.80 -58.53 -56.04 -58.04 0.38 9 0 "[ . 1 . 2]"
212 . 1 146 PRO N 1 146 PRO CA 1 146 PRO C 1 147 TYR N 130.00 170.00 140.87 130.90 129.79 0.85 9 0 "[ . 1 . 2]"
213 . 1 146 PRO C 1 147 TYR N 1 147 TYR CA 1 147 TYR C -165.70 -61.90 -75.52 -70.77 -79.85 0.40 12 0 "[ . 1 . 2]"
214 . 1 147 TYR N 1 147 TYR CA 1 147 TYR C 1 148 VAL N 61.60 168.80 153.14 131.15 169.82 1.02 18 0 "[ . 1 . 2]"
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