NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
635440 |
6drf   |
27305 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_6drf
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 172
_TA_constraint_stats_list.Viol_count 100
_TA_constraint_stats_list.Viol_total 1230.88
_TA_constraint_stats_list.Viol_max 5.81
_TA_constraint_stats_list.Viol_rms 0.39
_TA_constraint_stats_list.Viol_average_all_restraints 0.07
_TA_constraint_stats_list.Viol_average_violations_only 1.23
_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 1 ALA C 1 2 ARG N 1 2 ARG CA 1 2 ARG C -94.08 -54.08 -85.28 -92.22 -94.07 0.63 3 0 "[ . 1]"
2 . 1 2 ARG N 1 2 ARG CA 1 2 ARG C 1 3 SER N 120.92 169.42 146.57 129.89 161.30 . . 0 "[ . 1]"
3 . 1 2 ARG C 1 3 SER N 1 3 SER CA 1 3 SER C -90.64 -50.64 -77.19 -91.58 -60.01 0.94 8 0 "[ . 1]"
4 . 1 3 SER N 1 3 SER CA 1 3 SER C 1 4 PRO N 134.03 174.03 151.62 155.32 151.98 . . 0 "[ . 1]"
5 . 1 4 PRO N 1 4 PRO CA 1 4 PRO C 1 5 ALA N -56.66 -16.66 -25.44 -28.82 -31.72 0.62 10 0 "[ . 1]"
6 . 1 4 PRO C 1 5 ALA N 1 5 ALA CA 1 5 ALA C -86.69 -46.69 -59.73 -62.66 -56.07 . . 0 "[ . 1]"
7 . 1 5 ALA N 1 5 ALA CA 1 5 ALA C 1 6 GLU N -58.01 -18.01 -38.06 -38.28 -39.76 . . 0 "[ . 1]"
8 . 1 5 ALA C 1 6 GLU N 1 6 GLU CA 1 6 GLU C -87.68 -47.68 -68.93 -76.95 -62.68 . . 0 "[ . 1]"
9 . 1 6 GLU N 1 6 GLU CA 1 6 GLU C 1 7 MET N -58.08 -18.08 -48.10 -52.97 -42.38 . . 0 "[ . 1]"
10 . 1 6 GLU C 1 7 MET N 1 7 MET CA 1 7 MET C -85.81 -45.81 -54.65 -60.38 -51.27 . . 0 "[ . 1]"
11 . 1 7 MET N 1 7 MET CA 1 7 MET C 1 8 VAL N -61.61 -21.61 -44.85 -52.49 -32.70 . . 0 "[ . 1]"
12 . 1 7 MET C 1 8 VAL N 1 8 VAL CA 1 8 VAL C -83.94 -43.94 -64.82 -77.38 -57.22 . . 0 "[ . 1]"
13 . 1 8 VAL N 1 8 VAL CA 1 8 VAL C 1 9 LEU N -64.76 -24.76 -41.14 -36.93 -41.27 . . 0 "[ . 1]"
14 . 1 8 VAL C 1 9 LEU N 1 9 LEU CA 1 9 LEU C -81.83 -41.83 -57.45 -66.91 -50.02 . . 0 "[ . 1]"
15 . 1 9 LEU N 1 9 LEU CA 1 9 LEU C 1 10 GLU N -63.75 -23.75 -46.79 -44.93 -49.69 . . 0 "[ . 1]"
16 . 1 9 LEU C 1 10 GLU N 1 10 GLU CA 1 10 GLU C -84.35 -44.35 -61.97 -69.18 -54.87 . . 0 "[ . 1]"
17 . 1 10 GLU N 1 10 GLU CA 1 10 GLU C 1 11 THR N -61.33 -21.33 -42.65 -52.15 -27.25 . . 0 "[ . 1]"
18 . 1 10 GLU C 1 11 THR N 1 11 THR CA 1 11 THR C -86.30 -46.30 -61.65 -59.47 -61.92 . . 0 "[ . 1]"
19 . 1 11 THR N 1 11 THR CA 1 11 THR C 1 12 LEU N -63.55 -23.55 -41.99 -38.83 -41.06 . . 0 "[ . 1]"
20 . 1 11 THR C 1 12 LEU N 1 12 LEU CA 1 12 LEU C -84.35 -44.35 -74.00 -74.24 -82.27 . . 0 "[ . 1]"
21 . 1 12 LEU N 1 12 LEU CA 1 12 LEU C 1 13 MET N -61.51 -21.51 -42.79 -55.22 -38.18 . . 0 "[ . 1]"
22 . 1 12 LEU C 1 13 MET N 1 13 MET CA 1 13 MET C -85.69 -45.69 -74.06 -77.31 -67.52 . . 0 "[ . 1]"
23 . 1 13 MET N 1 13 MET CA 1 13 MET C 1 14 MET N -57.11 -17.11 -14.71 -13.82 -14.76 4.64 7 0 "[ . 1]"
24 . 1 13 MET C 1 14 MET N 1 14 MET CA 1 14 MET C -86.18 -46.18 -83.51 -82.51 -84.22 1.69 10 0 "[ . 1]"
25 . 1 14 MET N 1 14 MET CA 1 14 MET C 1 15 GLU N -63.07 -23.07 -41.87 -50.30 -36.94 . . 0 "[ . 1]"
26 . 1 14 MET C 1 15 GLU N 1 15 GLU CA 1 15 GLU C -84.24 -44.24 -75.75 -85.35 -65.09 1.11 2 0 "[ . 1]"
27 . 1 15 GLU C 1 16 LEU N 1 16 LEU CA 1 16 LEU C -84.26 -44.26 -55.95 -54.79 -55.16 . . 0 "[ . 1]"
28 . 1 16 LEU N 1 16 LEU CA 1 16 LEU C 1 17 THR N -63.17 -23.17 -45.34 -44.45 -44.94 . . 0 "[ . 1]"
29 . 1 16 LEU C 1 17 THR N 1 17 THR CA 1 17 THR C -83.95 -43.95 -67.06 -65.96 -66.40 . . 0 "[ . 1]"
30 . 1 17 THR N 1 17 THR CA 1 17 THR C 1 18 GLY N -62.06 -22.06 -51.74 -54.94 -47.38 . . 0 "[ . 1]"
31 . 1 17 THR C 1 18 GLY N 1 18 GLY CA 1 18 GLY C -82.88 -42.88 -60.87 -65.33 -59.22 . . 0 "[ . 1]"
32 . 1 18 GLY N 1 18 GLY CA 1 18 GLY C 1 19 GLN N -61.79 -21.79 -34.02 -34.23 -34.93 . . 0 "[ . 1]"
33 . 1 18 GLY C 1 19 GLN N 1 19 GLN CA 1 19 GLN C -87.69 -47.69 -83.62 -82.72 -82.82 . . 0 "[ . 1]"
34 . 1 19 GLN N 1 19 GLN CA 1 19 GLN C 1 20 MET N -57.07 -17.07 -30.36 -30.73 -30.80 . . 0 "[ . 1]"
35 . 1 19 GLN C 1 20 MET N 1 20 MET CA 1 20 MET C -85.06 -45.06 -65.79 -67.10 -62.31 . . 0 "[ . 1]"
36 . 1 20 MET N 1 20 MET CA 1 20 MET C 1 21 ARG N -64.72 -24.72 -42.34 -44.85 -48.75 . . 0 "[ . 1]"
37 . 1 20 MET C 1 21 ARG N 1 21 ARG CA 1 21 ARG C -83.85 -43.85 -69.09 -76.06 -61.53 . . 0 "[ . 1]"
38 . 1 21 ARG N 1 21 ARG CA 1 21 ARG C 1 22 GLU N -59.52 -19.52 -50.47 -49.59 -51.28 . . 0 "[ . 1]"
39 . 1 21 ARG C 1 22 GLU N 1 22 GLU CA 1 22 GLU C -85.50 -45.50 -54.46 -55.93 -56.29 . . 0 "[ . 1]"
40 . 1 22 GLU N 1 22 GLU CA 1 22 GLU C 1 23 ALA N -61.04 -21.04 -45.03 -50.13 -36.49 . . 0 "[ . 1]"
41 . 1 22 GLU C 1 23 ALA N 1 23 ALA CA 1 23 ALA C -84.45 -44.45 -60.69 -62.57 -63.06 . . 0 "[ . 1]"
42 . 1 23 ALA N 1 23 ALA CA 1 23 ALA C 1 24 GLU N -55.36 -15.36 -39.23 -36.71 -37.95 . . 0 "[ . 1]"
43 . 1 23 ALA C 1 24 GLU N 1 24 GLU CA 1 24 GLU C -84.94 -44.94 -62.85 -59.91 -62.13 . . 0 "[ . 1]"
44 . 1 24 GLU N 1 24 GLU CA 1 24 GLU C 1 25 ARG N -49.01 -9.01 -45.68 -36.16 -39.05 1.44 7 0 "[ . 1]"
45 . 1 28 ARG C 1 29 GLU N 1 29 GLU CA 1 29 GLU C -79.59 -39.59 -65.92 -74.39 -58.92 . . 0 "[ . 1]"
46 . 1 29 GLU N 1 29 GLU CA 1 29 GLU C 1 30 ARG N -53.92 -13.92 -39.82 -45.67 -28.84 . . 0 "[ . 1]"
47 . 1 29 GLU C 1 30 ARG N 1 30 ARG CA 1 30 ARG C -87.41 -47.41 -62.42 -70.22 -53.96 . . 0 "[ . 1]"
48 . 1 30 ARG N 1 30 ARG CA 1 30 ARG C 1 31 SER N -55.11 -15.11 -44.59 -45.27 -47.36 . . 0 "[ . 1]"
49 . 1 30 ARG C 1 31 SER N 1 31 SER CA 1 31 SER C -88.94 -48.94 -64.62 -70.86 -58.38 . . 0 "[ . 1]"
50 . 1 31 SER N 1 31 SER CA 1 31 SER C 1 32 ASN N -55.31 -15.31 -36.87 -46.39 -22.31 . . 0 "[ . 1]"
51 . 1 31 SER C 1 32 ASN N 1 32 ASN CA 1 32 ASN C -88.13 -48.13 -71.89 -61.67 -69.14 . . 0 "[ . 1]"
52 . 1 32 ASN N 1 32 ASN CA 1 32 ASN C 1 33 ALA N -54.52 -14.52 -31.18 -44.99 -16.33 . . 0 "[ . 1]"
53 . 1 32 ASN C 1 33 ALA N 1 33 ALA CA 1 33 ALA C -88.33 -48.33 -69.47 -72.36 -75.19 . . 0 "[ . 1]"
54 . 1 33 ALA N 1 33 ALA CA 1 33 ALA C 1 34 VAL N -46.77 -6.77 -42.87 -47.76 -36.21 0.99 4 0 "[ . 1]"
55 . 1 51 ASP C 1 52 SER N 1 52 SER CA 1 52 SER C -113.59 -37.11 -95.33 -114.76 -114.80 2.11 9 0 "[ . 1]"
56 . 1 52 SER N 1 52 SER CA 1 52 SER C 1 53 THR N 110.73 170.73 125.41 143.70 136.30 1.13 9 0 "[ . 1]"
57 . 1 52 SER C 1 53 THR N 1 53 THR CA 1 53 THR C -156.10 -88.08 -112.11 -150.38 -89.20 . . 0 "[ . 1]"
58 . 1 53 THR N 1 53 THR CA 1 53 THR C 1 54 TYR N 113.32 171.80 145.17 112.91 173.93 2.13 6 0 "[ . 1]"
59 . 1 53 THR C 1 54 TYR N 1 54 TYR CA 1 54 TYR C -105.88 -48.64 -88.02 -107.47 -62.50 1.59 4 0 "[ . 1]"
60 . 1 54 TYR N 1 54 TYR CA 1 54 TYR C 1 55 ASP N 111.12 151.12 131.42 121.03 109.82 3.63 9 0 "[ . 1]"
61 . 1 54 TYR C 1 55 ASP N 1 55 ASP CA 1 55 ASP C -158.76 -82.22 -150.45 -146.86 -159.48 5.81 9 1 "[ . +1]"
62 . 1 55 ASP N 1 55 ASP CA 1 55 ASP C 1 56 LEU N 106.04 173.86 128.14 125.15 121.46 . . 0 "[ . 1]"
63 . 1 55 ASP C 1 56 LEU N 1 56 LEU CA 1 56 LEU C -103.63 -49.53 -85.99 -105.65 -58.30 2.02 2 0 "[ . 1]"
64 . 1 57 SER N 1 57 SER CA 1 57 SER C 1 58 PRO N 131.76 174.76 152.74 141.02 167.11 . . 0 "[ . 1]"
65 . 1 58 PRO N 1 58 PRO CA 1 58 PRO C 1 59 ILE N -57.90 -17.90 -36.35 -43.15 -45.13 . . 0 "[ . 1]"
66 . 1 58 PRO C 1 59 ILE N 1 59 ILE CA 1 59 ILE C -86.69 -46.69 -72.03 -75.20 -69.15 . . 0 "[ . 1]"
67 . 1 59 ILE N 1 59 ILE CA 1 59 ILE C 1 60 GLU N -58.51 -18.51 -44.59 -41.17 -42.24 . . 0 "[ . 1]"
68 . 1 59 ILE C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -88.87 -48.87 -60.10 -64.75 -56.83 . . 0 "[ . 1]"
69 . 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 ARG N -59.44 -19.44 -42.74 -46.56 -37.05 . . 0 "[ . 1]"
70 . 1 60 GLU C 1 61 ARG N 1 61 ARG CA 1 61 ARG C -82.65 -42.65 -57.12 -57.12 -57.36 . . 0 "[ . 1]"
71 . 1 61 ARG N 1 61 ARG CA 1 61 ARG C 1 62 LEU N -61.51 -21.51 -53.48 -57.41 -47.09 . . 0 "[ . 1]"
72 . 1 61 ARG C 1 62 LEU N 1 62 LEU CA 1 62 LEU C -83.77 -43.77 -59.31 -63.18 -56.94 . . 0 "[ . 1]"
73 . 1 62 LEU N 1 62 LEU CA 1 62 LEU C 1 63 GLN N -63.63 -23.63 -44.11 -41.75 -44.18 . . 0 "[ . 1]"
74 . 1 62 LEU C 1 63 GLN N 1 63 GLN CA 1 63 GLN C -83.38 -43.38 -59.53 -63.38 -54.71 . . 0 "[ . 1]"
75 . 1 63 GLN N 1 63 GLN CA 1 63 GLN C 1 64 LEU N -63.10 -23.10 -47.26 -50.01 -53.73 . . 0 "[ . 1]"
76 . 1 63 GLN C 1 64 LEU N 1 64 LEU CA 1 64 LEU C -86.88 -46.88 -66.93 -67.53 -68.69 . . 0 "[ . 1]"
77 . 1 64 LEU N 1 64 LEU CA 1 64 LEU C 1 65 GLU N -60.84 -20.84 -35.33 -35.50 -36.49 . . 0 "[ . 1]"
78 . 1 64 LEU C 1 65 GLU N 1 65 GLU CA 1 65 GLU C -80.88 -40.88 -64.49 -68.37 -62.00 . . 0 "[ . 1]"
79 . 1 65 GLU N 1 65 GLU CA 1 65 GLU C 1 66 ASP N -62.17 -22.17 -44.05 -46.61 -40.97 . . 0 "[ . 1]"
80 . 1 65 GLU C 1 66 ASP N 1 66 ASP CA 1 66 ASP C -86.24 -46.24 -59.92 -60.45 -61.45 . . 0 "[ . 1]"
81 . 1 66 ASP N 1 66 ASP CA 1 66 ASP C 1 67 VAL N -57.82 -17.82 -40.51 -45.52 -36.87 . . 0 "[ . 1]"
82 . 1 66 ASP C 1 67 VAL N 1 67 VAL CA 1 67 VAL C -86.16 -46.16 -66.26 -66.54 -67.22 . . 0 "[ . 1]"
83 . 1 67 VAL N 1 67 VAL CA 1 67 VAL C 1 68 CYS N -62.71 -22.71 -41.71 -44.28 -46.19 . . 0 "[ . 1]"
84 . 1 67 VAL C 1 68 CYS N 1 68 CYS CA 1 68 CYS C -81.03 -41.03 -69.09 -80.13 -60.69 . . 0 "[ . 1]"
85 . 1 68 CYS N 1 68 CYS CA 1 68 CYS C 1 69 VAL N -58.29 -18.29 -37.21 -39.22 -43.61 . . 0 "[ . 1]"
86 . 1 68 CYS C 1 69 VAL N 1 69 VAL CA 1 69 VAL C -91.27 -51.27 -62.14 -65.42 -66.02 . . 0 "[ . 1]"
87 . 1 69 VAL N 1 69 VAL CA 1 69 VAL C 1 70 LYS N -36.76 3.24 -31.33 -36.92 -23.71 0.16 7 0 "[ . 1]"
88 . 1 69 VAL C 1 70 LYS N 1 70 LYS CA 1 70 LYS C -108.74 -68.74 -89.49 -98.59 -74.62 . . 0 "[ . 1]"
89 . 1 70 LYS N 1 70 LYS CA 1 70 LYS C 1 71 ILE N -28.69 11.31 3.81 -29.33 11.73 0.64 7 0 "[ . 1]"
90 . 1 70 LYS C 1 71 ILE N 1 71 ILE CA 1 71 ILE C -100.07 -40.07 -89.82 -94.98 -96.11 . . 0 "[ . 1]"
91 . 1 71 ILE N 1 71 ILE CA 1 71 ILE C 1 72 HIS N 86.51 -166.21 144.47 133.18 -179.33 . . 0 "[ . 1]"
92 . 1 71 ILE C 1 72 HIS N 1 72 HIS CA 1 72 HIS C -99.78 -25.74 -79.35 -66.31 -67.21 3.53 10 0 "[ . 1]"
93 . 1 72 HIS N 1 72 HIS CA 1 72 HIS C 1 73 PRO N 115.95 160.95 139.69 136.82 136.14 . . 0 "[ . 1]"
94 . 1 73 PRO C 1 74 SER N 1 74 SER CA 1 74 SER C -82.92 -42.92 -75.44 -78.49 -81.15 . . 0 "[ . 1]"
95 . 1 74 SER N 1 74 SER CA 1 74 SER C 1 75 TYR N -49.22 -9.22 -14.72 -8.87 -12.19 4.04 4 0 "[ . 1]"
96 . 1 74 SER C 1 75 TYR N 1 75 TYR CA 1 75 TYR C -119.27 -56.75 -81.89 -93.85 -69.28 . . 0 "[ . 1]"
97 . 1 75 TYR N 1 75 TYR CA 1 75 TYR C 1 76 CYS N -44.69 24.01 -21.51 -19.11 -19.72 . . 0 "[ . 1]"
98 . 1 75 TYR C 1 76 CYS N 1 76 CYS CA 1 76 CYS C -81.79 -41.79 -61.60 -67.18 -56.49 . . 0 "[ . 1]"
99 . 1 76 CYS N 1 76 CYS CA 1 76 CYS C 1 77 GLY N -63.50 -23.50 -45.18 -49.00 -41.36 . . 0 "[ . 1]"
100 . 1 76 CYS C 1 77 GLY N 1 77 GLY CA 1 77 GLY C -78.47 -38.47 -46.33 -49.02 -44.16 . . 0 "[ . 1]"
101 . 1 77 GLY N 1 77 GLY CA 1 77 GLY C 1 78 PRO N -72.55 -32.55 -67.49 -65.39 -65.65 . . 0 "[ . 1]"
102 . 1 78 PRO N 1 78 PRO CA 1 78 PRO C 1 79 ALA N -57.52 -17.52 -50.46 -49.94 -50.79 . . 0 "[ . 1]"
103 . 1 78 PRO C 1 79 ALA N 1 79 ALA CA 1 79 ALA C -86.83 -46.83 -46.15 -46.31 -46.33 1.30 4 0 "[ . 1]"
104 . 1 79 ALA N 1 79 ALA CA 1 79 ALA C 1 80 ILE N -59.70 -19.70 -44.20 -46.84 -40.17 . . 0 "[ . 1]"
105 . 1 79 ALA C 1 80 ILE N 1 80 ILE CA 1 80 ILE C -86.00 -46.00 -69.67 -75.48 -64.84 . . 0 "[ . 1]"
106 . 1 80 ILE N 1 80 ILE CA 1 80 ILE C 1 81 LEU N -60.91 -20.91 -48.38 -49.50 -50.60 . . 0 "[ . 1]"
107 . 1 80 ILE C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -84.34 -44.34 -56.76 -53.69 -54.74 . . 0 "[ . 1]"
108 . 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 ARG N -51.31 -11.31 -43.75 -43.74 -46.22 0.13 4 0 "[ . 1]"
109 . 1 86 LEU C 1 87 LEU N 1 87 LEU CA 1 87 LEU C -84.28 -44.28 -58.71 -60.51 -61.49 . . 0 "[ . 1]"
110 . 1 87 LEU N 1 87 LEU CA 1 87 LEU C 1 88 ALA N -59.21 -19.21 -38.51 -40.04 -36.57 . . 0 "[ . 1]"
111 . 1 87 LEU C 1 88 ALA N 1 88 ALA CA 1 88 ALA C -88.96 -48.96 -72.48 -79.49 -68.16 . . 0 "[ . 1]"
112 . 1 88 ALA N 1 88 ALA CA 1 88 ALA C 1 89 GLU N -58.13 -18.13 -29.49 -32.77 -24.66 . . 0 "[ . 1]"
113 . 1 88 ALA C 1 89 GLU N 1 89 GLU CA 1 89 GLU C -89.45 -49.45 -77.74 -80.78 -74.49 . . 0 "[ . 1]"
114 . 1 89 GLU N 1 89 GLU CA 1 89 GLU C 1 90 GLN N -49.88 -9.88 -37.71 -41.01 -31.39 . . 0 "[ . 1]"
115 . 1 89 GLU C 1 90 GLN N 1 90 GLN CA 1 90 GLN C -105.97 -63.43 -86.36 -88.91 -102.05 . . 0 "[ . 1]"
116 . 1 90 GLN N 1 90 GLN CA 1 90 GLN C 1 91 GLU N -41.57 4.75 -6.36 -4.32 -4.92 . . 0 "[ . 1]"
117 . 1 92 PRO N 1 92 PRO CA 1 92 PRO C 1 93 GLU N 120.61 -179.39 132.00 120.02 149.15 0.59 9 0 "[ . 1]"
118 . 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 VAL N 97.36 174.88 104.98 95.40 124.11 1.96 5 0 "[ . 1]"
119 . 1 93 GLU C 1 94 VAL N 1 94 VAL CA 1 94 VAL C -79.11 -39.11 -51.00 -50.90 -63.21 . . 0 "[ . 1]"
120 . 1 94 VAL N 1 94 VAL CA 1 94 VAL C 1 95 GLN N -54.81 -14.81 -35.60 -42.05 -30.08 . . 0 "[ . 1]"
121 . 1 94 VAL C 1 95 GLN N 1 95 GLN CA 1 95 GLN C -86.68 -46.68 -68.77 -74.49 -61.30 . . 0 "[ . 1]"
122 . 1 95 GLN N 1 95 GLN CA 1 95 GLN C 1 96 GLU N -43.64 -3.64 -34.72 -34.22 -35.22 0.02 9 0 "[ . 1]"
123 . 1 95 GLN C 1 96 GLU N 1 96 GLU CA 1 96 GLU C -119.08 -79.08 -82.17 -78.93 -79.02 0.15 2 0 "[ . 1]"
124 . 1 96 GLU N 1 96 GLU CA 1 96 GLU C 1 97 VAL N -46.27 42.11 -32.84 -38.89 -25.62 . . 0 "[ . 1]"
125 . 1 96 GLU C 1 97 VAL N 1 97 VAL CA 1 97 VAL C -78.48 -38.48 -55.80 -57.64 -53.80 . . 0 "[ . 1]"
126 . 1 97 VAL N 1 97 VAL CA 1 97 VAL C 1 98 SER N -64.89 -24.89 -54.50 -55.07 -55.35 . . 0 "[ . 1]"
127 . 1 97 VAL C 1 98 SER N 1 98 SER CA 1 98 SER C -83.10 -43.10 -64.90 -68.38 -62.59 . . 0 "[ . 1]"
128 . 1 98 SER N 1 98 SER CA 1 98 SER C 1 99 GLN N -60.49 -20.49 -42.23 -44.74 -47.87 . . 0 "[ . 1]"
129 . 1 98 SER C 1 99 GLN N 1 99 GLN CA 1 99 GLN C -85.43 -45.43 -66.47 -68.10 -71.03 . . 0 "[ . 1]"
130 . 1 99 GLN N 1 99 GLN CA 1 99 GLN C 1 100 LEU N -60.12 -20.12 -41.56 -44.88 -33.66 . . 0 "[ . 1]"
131 . 1 99 GLN C 1 100 LEU N 1 100 LEU CA 1 100 LEU C -84.63 -44.63 -72.83 -75.70 -79.23 . . 0 "[ . 1]"
132 . 1 100 LEU N 1 100 LEU CA 1 100 LEU C 1 101 PHE N -63.80 -23.80 -31.68 -31.75 -31.82 . . 0 "[ . 1]"
133 . 1 100 LEU C 1 101 PHE N 1 101 PHE CA 1 101 PHE C -83.14 -43.14 -67.40 -68.72 -65.06 . . 0 "[ . 1]"
134 . 1 101 PHE N 1 101 PHE CA 1 101 PHE C 1 102 ARG N -62.77 -22.77 -42.08 -41.96 -44.10 . . 0 "[ . 1]"
135 . 1 101 PHE C 1 102 ARG N 1 102 ARG CA 1 102 ARG C -82.01 -42.01 -74.57 -76.03 -76.51 . . 0 "[ . 1]"
136 . 1 102 ARG N 1 102 ARG CA 1 102 ARG C 1 103 SER N -61.27 -21.27 -36.18 -42.84 -32.21 . . 0 "[ . 1]"
137 . 1 102 ARG C 1 103 SER N 1 103 SER CA 1 103 SER C -84.89 -44.89 -60.14 -60.38 -61.29 . . 0 "[ . 1]"
138 . 1 103 SER N 1 103 SER CA 1 103 SER C 1 104 VAL N -58.65 -18.65 -59.92 -59.97 -60.37 2.80 10 0 "[ . 1]"
139 . 1 103 SER C 1 104 VAL N 1 104 VAL CA 1 104 VAL C -85.73 -45.73 -58.32 -56.77 -58.37 . . 0 "[ . 1]"
140 . 1 104 VAL N 1 104 VAL CA 1 104 VAL C 1 105 LEU N -63.72 -23.72 -41.00 -43.62 -44.25 . . 0 "[ . 1]"
141 . 1 104 VAL C 1 105 LEU N 1 105 LEU CA 1 105 LEU C -83.75 -43.75 -62.29 -65.09 -57.81 . . 0 "[ . 1]"
142 . 1 105 LEU N 1 105 LEU CA 1 105 LEU C 1 106 GLN N -60.76 -20.76 -36.81 -33.87 -35.17 . . 0 "[ . 1]"
143 . 1 105 LEU C 1 106 GLN N 1 106 GLN CA 1 106 GLN C -83.79 -43.79 -75.75 -78.72 -70.47 . . 0 "[ . 1]"
144 . 1 106 GLN N 1 106 GLN CA 1 106 GLN C 1 107 GLU N -60.24 -20.24 -30.94 -29.64 -31.29 . . 0 "[ . 1]"
145 . 1 106 GLN C 1 107 GLU N 1 107 GLU CA 1 107 GLU C -87.69 -47.69 -66.17 -65.07 -66.56 . . 0 "[ . 1]"
146 . 1 107 GLU N 1 107 GLU CA 1 107 GLU C 1 108 VAL N -61.67 -21.67 -52.79 -56.85 -46.15 . . 0 "[ . 1]"
147 . 1 107 GLU C 1 108 VAL N 1 108 VAL CA 1 108 VAL C -83.89 -43.89 -67.03 -66.09 -66.27 . . 0 "[ . 1]"
148 . 1 108 VAL N 1 108 VAL CA 1 108 VAL C 1 109 LEU N -61.88 -21.88 -27.94 -27.31 -28.05 . . 0 "[ . 1]"
149 . 1 108 VAL C 1 109 LEU N 1 109 LEU CA 1 109 LEU C -83.67 -43.67 -63.14 -62.25 -65.08 . . 0 "[ . 1]"
150 . 1 109 LEU N 1 109 LEU CA 1 109 LEU C 1 110 GLU N -56.27 -16.27 -49.22 -56.95 -43.17 0.68 7 0 "[ . 1]"
151 . 1 111 ARG C 1 112 MET N 1 112 MET CA 1 112 MET C -82.55 -42.55 -69.72 -83.25 -56.67 0.70 5 0 "[ . 1]"
152 . 1 112 MET N 1 112 MET CA 1 112 MET C 1 113 LYS N -62.74 -22.74 -41.76 -52.32 -33.87 . . 0 "[ . 1]"
153 . 1 112 MET C 1 113 LYS N 1 113 LYS CA 1 113 LYS C -85.64 -45.64 -62.55 -69.85 -59.21 . . 0 "[ . 1]"
154 . 1 113 LYS N 1 113 LYS CA 1 113 LYS C 1 114 GLN N -56.25 -16.25 -42.66 -40.14 -41.72 . . 0 "[ . 1]"
155 . 1 113 LYS C 1 114 GLN N 1 114 GLN CA 1 114 GLN C -85.94 -45.94 -62.74 -59.55 -60.66 . . 0 "[ . 1]"
156 . 1 114 GLN N 1 114 GLN CA 1 114 GLN C 1 115 GLU N -64.11 -24.11 -47.32 -53.61 -38.65 . . 0 "[ . 1]"
157 . 1 114 GLN C 1 115 GLU N 1 115 GLU CA 1 115 GLU C -86.64 -46.64 -60.47 -61.88 -65.90 . . 0 "[ . 1]"
158 . 1 115 GLU N 1 115 GLU CA 1 115 GLU C 1 116 GLU N -56.94 -16.94 -39.43 -49.04 -25.68 . . 0 "[ . 1]"
159 . 1 115 GLU C 1 116 GLU N 1 116 GLU CA 1 116 GLU C -85.71 -45.71 -61.27 -67.02 -56.72 . . 0 "[ . 1]"
160 . 1 116 GLU N 1 116 GLU CA 1 116 GLU C 1 117 GLU N -62.77 -22.77 -60.05 -59.04 -61.21 1.58 1 0 "[ . 1]"
161 . 1 116 GLU C 1 117 GLU N 1 117 GLU CA 1 117 GLU C -85.26 -45.26 -53.86 -52.66 -53.06 . . 0 "[ . 1]"
162 . 1 117 GLU N 1 117 GLU CA 1 117 GLU C 1 118 ALA N -59.80 -19.80 -40.82 -50.20 -30.58 . . 0 "[ . 1]"
163 . 1 117 GLU C 1 118 ALA N 1 118 ALA CA 1 118 ALA C -85.81 -45.81 -60.64 -61.99 -64.09 . . 0 "[ . 1]"
164 . 1 118 ALA N 1 118 ALA CA 1 118 ALA C 1 119 HIS N -57.65 -17.65 -44.73 -55.03 -33.69 . . 0 "[ . 1]"
165 . 1 118 ALA C 1 119 HIS N 1 119 HIS CA 1 119 HIS C -86.79 -46.79 -75.47 -82.44 -67.58 . . 0 "[ . 1]"
166 . 1 119 HIS N 1 119 HIS CA 1 119 HIS C 1 120 LYS N -56.56 -16.56 -33.03 -29.56 -42.23 0.48 3 0 "[ . 1]"
167 . 1 119 HIS C 1 120 LYS N 1 120 LYS CA 1 120 LYS C -86.85 -46.85 -70.76 -76.61 -60.78 . . 0 "[ . 1]"
168 . 1 120 LYS N 1 120 LYS CA 1 120 LYS C 1 121 LEU N -57.92 -17.92 -40.81 -42.73 -45.00 . . 0 "[ . 1]"
169 . 1 120 LYS C 1 121 LEU N 1 121 LEU CA 1 121 LEU C -90.21 -50.21 -66.38 -60.37 -60.55 . . 0 "[ . 1]"
170 . 1 121 LEU N 1 121 LEU CA 1 121 LEU C 1 122 THR N -54.12 -14.12 -39.48 -54.33 -12.50 1.62 8 0 "[ . 1]"
171 . 1 121 LEU C 1 122 THR N 1 122 THR CA 1 122 THR C -91.85 -51.85 -69.55 -66.32 -68.60 . . 0 "[ . 1]"
172 . 1 122 THR N 1 122 THR CA 1 122 THR C 1 123 ARG N -59.70 3.98 -29.72 -60.99 6.47 2.49 3 0 "[ . 1]"
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