NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
508618 |
2ep4   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2ep4
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 324
_TA_constraint_stats_list.Viol_count 126
_TA_constraint_stats_list.Viol_total 3291.17
_TA_constraint_stats_list.Viol_max 7.69
_TA_constraint_stats_list.Viol_rms 0.28
_TA_constraint_stats_list.Viol_average_all_restraints 0.03
_TA_constraint_stats_list.Viol_average_violations_only 1.31
_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 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG -90.00 -150.00 148.54 -87.52 -155.21 . . 0 "[ . 1 . 2]"
2 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG 30.00 -30.00 148.54 -87.52 -155.21 . . 0 "[ . 1 . 2]"
3 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG 150.00 90.00 148.54 -87.52 -155.21 . . 0 "[ . 1 . 2]"
4 CHI1 1 3 SER N 1 3 SER CA 1 3 SER CB 1 3 SER OG -90.00 -150.00 112.55 171.68 73.96 . . 0 "[ . 1 . 2]"
5 CHI1 1 3 SER N 1 3 SER CA 1 3 SER CB 1 3 SER OG 30.00 -30.00 112.55 171.68 73.96 . . 0 "[ . 1 . 2]"
6 CHI1 1 3 SER N 1 3 SER CA 1 3 SER CB 1 3 SER OG 150.00 90.00 112.55 171.68 73.96 . . 0 "[ . 1 . 2]"
7 CHI1 1 5 SER N 1 5 SER CA 1 5 SER CB 1 5 SER OG -90.00 -150.00 -151.54 -156.59 -166.37 . . 0 "[ . 1 . 2]"
8 CHI1 1 5 SER N 1 5 SER CA 1 5 SER CB 1 5 SER OG 30.00 -30.00 -151.54 -156.59 -166.37 . . 0 "[ . 1 . 2]"
9 CHI1 1 5 SER N 1 5 SER CA 1 5 SER CB 1 5 SER OG 150.00 90.00 -151.54 -156.59 -166.37 . . 0 "[ . 1 . 2]"
10 CHI1 1 6 SER N 1 6 SER CA 1 6 SER CB 1 6 SER OG -90.00 -150.00 -150.82 -86.63 -161.09 . . 0 "[ . 1 . 2]"
11 CHI1 1 6 SER N 1 6 SER CA 1 6 SER CB 1 6 SER OG 30.00 -30.00 -150.82 -86.63 -161.09 . . 0 "[ . 1 . 2]"
12 CHI1 1 6 SER N 1 6 SER CA 1 6 SER CB 1 6 SER OG 150.00 90.00 -150.82 -86.63 -161.09 . . 0 "[ . 1 . 2]"
13 CHI1 1 8 LYS N 1 8 LYS CA 1 8 LYS CB 1 8 LYS CG -90.00 -150.00 -132.50 -89.45 -148.41 1.59 14 0 "[ . 1 . 2]"
14 CHI1 1 8 LYS N 1 8 LYS CA 1 8 LYS CB 1 8 LYS CG 30.00 -30.00 -132.50 -89.45 -148.41 . . 0 "[ . 1 . 2]"
15 CHI1 1 8 LYS N 1 8 LYS CA 1 8 LYS CB 1 8 LYS CG 150.00 90.00 -132.50 -89.45 -148.41 . . 0 "[ . 1 . 2]"
16 CHI2 1 8 LYS CA 1 8 LYS CB 1 8 LYS CG 1 8 LYS CD -90.00 -150.00 -178.94 69.05 -78.41 1.04 11 0 "[ . 1 . 2]"
17 CHI2 1 8 LYS CA 1 8 LYS CB 1 8 LYS CG 1 8 LYS CD 30.00 -30.00 -178.94 69.05 -78.41 . . 0 "[ . 1 . 2]"
18 CHI2 1 8 LYS CA 1 8 LYS CB 1 8 LYS CG 1 8 LYS CD 150.00 90.00 -178.94 69.05 -78.41 4.32 19 0 "[ . 1 . 2]"
19 CHI3 1 8 LYS CB 1 8 LYS CG 1 8 LYS CD 1 8 LYS CE -90.00 -150.00 171.80 -94.62 -161.05 4.62 19 0 "[ . 1 . 2]"
20 CHI3 1 8 LYS CB 1 8 LYS CG 1 8 LYS CD 1 8 LYS CE 30.00 -30.00 171.80 -94.62 -161.05 . . 0 "[ . 1 . 2]"
21 CHI3 1 8 LYS CB 1 8 LYS CG 1 8 LYS CD 1 8 LYS CE 150.00 90.00 171.80 -94.62 -161.05 0.57 20 0 "[ . 1 . 2]"
22 CHI4 1 8 LYS CG 1 8 LYS CD 1 8 LYS CE 1 8 LYS NZ -90.00 -150.00 -151.20 151.79 84.69 1.14 20 0 "[ . 1 . 2]"
23 CHI4 1 8 LYS CG 1 8 LYS CD 1 8 LYS CE 1 8 LYS NZ 30.00 -30.00 -151.20 151.79 84.69 . . 0 "[ . 1 . 2]"
24 CHI4 1 8 LYS CG 1 8 LYS CD 1 8 LYS CE 1 8 LYS NZ 150.00 90.00 -151.20 151.79 84.69 . . 0 "[ . 1 . 2]"
25 CHI1 1 9 VAL N 1 9 VAL CA 1 9 VAL CB 1 9 VAL CG1 -90.00 -150.00 178.32 50.00 -59.70 . . 0 "[ . 1 . 2]"
26 CHI1 1 9 VAL N 1 9 VAL CA 1 9 VAL CB 1 9 VAL CG1 30.00 -30.00 178.32 50.00 -59.70 . . 0 "[ . 1 . 2]"
27 CHI1 1 9 VAL N 1 9 VAL CA 1 9 VAL CB 1 9 VAL CG1 150.00 90.00 178.32 50.00 -59.70 . . 0 "[ . 1 . 2]"
28 CHI1 1 10 LYS N 1 10 LYS CA 1 10 LYS CB 1 10 LYS CG -90.00 -150.00 -132.86 -174.66 71.30 0.53 9 0 "[ . 1 . 2]"
29 CHI1 1 10 LYS N 1 10 LYS CA 1 10 LYS CB 1 10 LYS CG 30.00 -30.00 -132.86 -174.66 71.30 . . 0 "[ . 1 . 2]"
30 CHI1 1 10 LYS N 1 10 LYS CA 1 10 LYS CB 1 10 LYS CG 150.00 90.00 -132.86 -174.66 71.30 . . 0 "[ . 1 . 2]"
31 CHI2 1 10 LYS CA 1 10 LYS CB 1 10 LYS CG 1 10 LYS CD -90.00 -150.00 175.31 82.04 -70.37 . . 0 "[ . 1 . 2]"
32 CHI2 1 10 LYS CA 1 10 LYS CB 1 10 LYS CG 1 10 LYS CD 30.00 -30.00 175.31 82.04 -70.37 . . 0 "[ . 1 . 2]"
33 CHI2 1 10 LYS CA 1 10 LYS CB 1 10 LYS CG 1 10 LYS CD 150.00 90.00 175.31 82.04 -70.37 2.06 12 0 "[ . 1 . 2]"
34 CHI3 1 10 LYS CB 1 10 LYS CG 1 10 LYS CD 1 10 LYS CE -90.00 -150.00 -167.25 74.71 -80.61 0.31 7 0 "[ . 1 . 2]"
35 CHI3 1 10 LYS CB 1 10 LYS CG 1 10 LYS CD 1 10 LYS CE 30.00 -30.00 -167.25 74.71 -80.61 . . 0 "[ . 1 . 2]"
36 CHI3 1 10 LYS CB 1 10 LYS CG 1 10 LYS CD 1 10 LYS CE 150.00 90.00 -167.25 74.71 -80.61 . . 0 "[ . 1 . 2]"
37 CHI4 1 10 LYS CG 1 10 LYS CD 1 10 LYS CE 1 10 LYS NZ -90.00 -150.00 175.37 65.28 -69.96 . . 0 "[ . 1 . 2]"
38 CHI4 1 10 LYS CG 1 10 LYS CD 1 10 LYS CE 1 10 LYS NZ 30.00 -30.00 175.37 65.28 -69.96 . . 0 "[ . 1 . 2]"
39 CHI4 1 10 LYS CG 1 10 LYS CD 1 10 LYS CE 1 10 LYS NZ 150.00 90.00 175.37 65.28 -69.96 . . 0 "[ . 1 . 2]"
40 CHI1 1 11 GLU N 1 11 GLU CA 1 11 GLU CB 1 11 GLU CG -90.00 -150.00 -61.20 -87.73 -176.16 . . 0 "[ . 1 . 2]"
41 CHI1 1 11 GLU N 1 11 GLU CA 1 11 GLU CB 1 11 GLU CG 30.00 -30.00 -61.20 -87.73 -176.16 . . 0 "[ . 1 . 2]"
42 CHI1 1 11 GLU N 1 11 GLU CA 1 11 GLU CB 1 11 GLU CG 150.00 90.00 -61.20 -87.73 -176.16 . . 0 "[ . 1 . 2]"
43 CHI2 1 11 GLU CA 1 11 GLU CB 1 11 GLU CG 1 11 GLU CD -90.00 -150.00 -161.95 -79.24 -154.70 . . 0 "[ . 1 . 2]"
44 CHI2 1 11 GLU CA 1 11 GLU CB 1 11 GLU CG 1 11 GLU CD 30.00 -30.00 -161.95 -79.24 -154.70 . . 0 "[ . 1 . 2]"
45 CHI2 1 11 GLU CA 1 11 GLU CB 1 11 GLU CG 1 11 GLU CD 150.00 90.00 -161.95 -79.24 -154.70 . . 0 "[ . 1 . 2]"
46 CHI1 1 12 LEU N 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG -90.00 -150.00 -67.50 161.42 74.23 0.16 8 0 "[ . 1 . 2]"
47 CHI1 1 12 LEU N 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG 30.00 -30.00 -67.50 161.42 74.23 . . 0 "[ . 1 . 2]"
48 CHI1 1 12 LEU N 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG 150.00 90.00 -67.50 161.42 74.23 . . 0 "[ . 1 . 2]"
49 CHI2 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG 1 12 LEU CD1 -90.00 -150.00 108.40 64.64 -66.33 . . 0 "[ . 1 . 2]"
50 CHI2 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG 1 12 LEU CD1 30.00 -30.00 108.40 64.64 -66.33 . . 0 "[ . 1 . 2]"
51 CHI2 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG 1 12 LEU CD1 150.00 90.00 108.40 64.64 -66.33 5.16 7 1 "[ . + 1 . 2]"
52 CHI1 1 13 ASN N 1 13 ASN CA 1 13 ASN CB 1 13 ASN CG -90.00 -150.00 -83.00 -84.05 -151.86 . . 0 "[ . 1 . 2]"
53 CHI1 1 13 ASN N 1 13 ASN CA 1 13 ASN CB 1 13 ASN CG 30.00 -30.00 -83.00 -84.05 -151.86 . . 0 "[ . 1 . 2]"
54 CHI1 1 13 ASN N 1 13 ASN CA 1 13 ASN CB 1 13 ASN CG 150.00 90.00 -83.00 -84.05 -151.86 . . 0 "[ . 1 . 2]"
55 CHI1 1 14 LEU N 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG -90.00 -150.00 -107.18 175.37 -57.02 0.34 2 0 "[ . 1 . 2]"
56 CHI1 1 14 LEU N 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG 30.00 -30.00 -107.18 175.37 -57.02 . . 0 "[ . 1 . 2]"
57 CHI1 1 14 LEU N 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG 150.00 90.00 -107.18 175.37 -57.02 . . 0 "[ . 1 . 2]"
58 CHI2 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG 1 14 LEU CD1 -90.00 -150.00 132.33 -59.56 168.33 . . 0 "[ . 1 . 2]"
59 CHI2 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG 1 14 LEU CD1 30.00 -30.00 132.33 -59.56 168.33 . . 0 "[ . 1 . 2]"
60 CHI2 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG 1 14 LEU CD1 150.00 90.00 132.33 -59.56 168.33 1.45 14 0 "[ . 1 . 2]"
61 CHI1 1 15 HIS N 1 15 HIS CA 1 15 HIS CB 1 15 HIS CG -90.00 -150.00 -87.92 164.14 69.98 . . 0 "[ . 1 . 2]"
62 CHI1 1 15 HIS N 1 15 HIS CA 1 15 HIS CB 1 15 HIS CG 30.00 -30.00 -87.92 164.14 69.98 . . 0 "[ . 1 . 2]"
63 CHI1 1 15 HIS N 1 15 HIS CA 1 15 HIS CB 1 15 HIS CG 150.00 90.00 -87.92 164.14 69.98 . . 0 "[ . 1 . 2]"
64 CHI1 1 16 GLU N 1 16 GLU CA 1 16 GLU CB 1 16 GLU CG -90.00 -150.00 -103.34 -92.80 -150.51 2.80 6 0 "[ . 1 . 2]"
65 CHI1 1 16 GLU N 1 16 GLU CA 1 16 GLU CB 1 16 GLU CG 30.00 -30.00 -103.34 -92.80 -150.51 . . 0 "[ . 1 . 2]"
66 CHI1 1 16 GLU N 1 16 GLU CA 1 16 GLU CB 1 16 GLU CG 150.00 90.00 -103.34 -92.80 -150.51 . . 0 "[ . 1 . 2]"
67 CHI2 1 16 GLU CA 1 16 GLU CB 1 16 GLU CG 1 16 GLU CD -90.00 -150.00 178.81 -80.78 -158.11 . . 0 "[ . 1 . 2]"
68 CHI2 1 16 GLU CA 1 16 GLU CB 1 16 GLU CG 1 16 GLU CD 30.00 -30.00 178.81 -80.78 -158.11 . . 0 "[ . 1 . 2]"
69 CHI2 1 16 GLU CA 1 16 GLU CB 1 16 GLU CG 1 16 GLU CD 150.00 90.00 178.81 -80.78 -158.11 0.42 4 0 "[ . 1 . 2]"
70 CHI1 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG -90.00 -150.00 -46.78 -61.35 -29.88 . . 0 "[ . 1 . 2]"
71 CHI1 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 30.00 -30.00 -46.78 -61.35 -29.88 0.12 9 0 "[ . 1 . 2]"
72 CHI1 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 150.00 90.00 -46.78 -61.35 -29.88 . . 0 "[ . 1 . 2]"
73 CHI2 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 1 17 LEU CD1 -90.00 -150.00 153.94 166.98 163.40 . . 0 "[ . 1 . 2]"
74 CHI2 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 1 17 LEU CD1 30.00 -30.00 153.94 166.98 163.40 . . 0 "[ . 1 . 2]"
75 CHI2 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 1 17 LEU CD1 150.00 90.00 153.94 166.98 163.40 1.42 15 0 "[ . 1 . 2]"
76 CHI1 1 18 CYS N 1 18 CYS CA 1 18 CYS CB 1 18 CYS SG -90.00 -150.00 -172.33 176.54 -165.52 . . 0 "[ . 1 . 2]"
77 CHI1 1 18 CYS N 1 18 CYS CA 1 18 CYS CB 1 18 CYS SG 30.00 -30.00 -172.33 176.54 -165.52 . . 0 "[ . 1 . 2]"
78 CHI1 1 18 CYS N 1 18 CYS CA 1 18 CYS CB 1 18 CYS SG 150.00 90.00 -172.33 176.54 -165.52 . . 0 "[ . 1 . 2]"
79 CHI1 1 20 VAL N 1 20 VAL CA 1 20 VAL CB 1 20 VAL CG1 -90.00 -150.00 179.44 -177.94 -179.24 . . 0 "[ . 1 . 2]"
80 CHI1 1 20 VAL N 1 20 VAL CA 1 20 VAL CB 1 20 VAL CG1 30.00 -30.00 179.44 -177.94 -179.24 . . 0 "[ . 1 . 2]"
81 CHI1 1 20 VAL N 1 20 VAL CA 1 20 VAL CB 1 20 VAL CG1 150.00 90.00 179.44 -177.94 -179.24 . . 0 "[ . 1 . 2]"
82 CHI1 1 21 CYS N 1 21 CYS CA 1 21 CYS CB 1 21 CYS SG -90.00 -150.00 68.11 60.38 76.70 . . 0 "[ . 1 . 2]"
83 CHI1 1 21 CYS N 1 21 CYS CA 1 21 CYS CB 1 21 CYS SG 30.00 -30.00 68.11 60.38 76.70 . . 0 "[ . 1 . 2]"
84 CHI1 1 21 CYS N 1 21 CYS CA 1 21 CYS CB 1 21 CYS SG 150.00 90.00 68.11 60.38 76.70 . . 0 "[ . 1 . 2]"
85 CHI1 1 22 LEU N 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG -90.00 -150.00 -59.54 -88.27 -49.72 . . 0 "[ . 1 . 2]"
86 CHI1 1 22 LEU N 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 30.00 -30.00 -59.54 -88.27 -49.72 . . 0 "[ . 1 . 2]"
87 CHI1 1 22 LEU N 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 150.00 90.00 -59.54 -88.27 -49.72 . . 0 "[ . 1 . 2]"
88 CHI2 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 1 22 LEU CD1 -90.00 -150.00 156.46 160.90 156.28 . . 0 "[ . 1 . 2]"
89 CHI2 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 1 22 LEU CD1 30.00 -30.00 156.46 160.90 156.28 . . 0 "[ . 1 . 2]"
90 CHI2 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG 1 22 LEU CD1 150.00 90.00 156.46 160.90 156.28 0.50 6 0 "[ . 1 . 2]"
91 CHI1 1 23 GLU N 1 23 GLU CA 1 23 GLU CB 1 23 GLU CG -90.00 -150.00 -78.24 -72.25 -75.61 . . 0 "[ . 1 . 2]"
92 CHI1 1 23 GLU N 1 23 GLU CA 1 23 GLU CB 1 23 GLU CG 30.00 -30.00 -78.24 -72.25 -75.61 . . 0 "[ . 1 . 2]"
93 CHI1 1 23 GLU N 1 23 GLU CA 1 23 GLU CB 1 23 GLU CG 150.00 90.00 -78.24 -72.25 -75.61 . . 0 "[ . 1 . 2]"
94 CHI2 1 23 GLU CA 1 23 GLU CB 1 23 GLU CG 1 23 GLU CD -90.00 -150.00 -152.44 175.28 169.27 . . 0 "[ . 1 . 2]"
95 CHI2 1 23 GLU CA 1 23 GLU CB 1 23 GLU CG 1 23 GLU CD 30.00 -30.00 -152.44 175.28 169.27 . . 0 "[ . 1 . 2]"
96 CHI2 1 23 GLU CA 1 23 GLU CB 1 23 GLU CG 1 23 GLU CD 150.00 90.00 -152.44 175.28 169.27 . . 0 "[ . 1 . 2]"
97 CHI1 1 24 ASP N 1 24 ASP CA 1 24 ASP CB 1 24 ASP CG -90.00 -150.00 4.08 -79.04 -151.17 . . 0 "[ . 1 . 2]"
98 CHI1 1 24 ASP N 1 24 ASP CA 1 24 ASP CB 1 24 ASP CG 30.00 -30.00 4.08 -79.04 -151.17 . . 0 "[ . 1 . 2]"
99 CHI1 1 24 ASP N 1 24 ASP CA 1 24 ASP CB 1 24 ASP CG 150.00 90.00 4.08 -79.04 -151.17 . . 0 "[ . 1 . 2]"
100 CHI1 1 25 PHE N 1 25 PHE CA 1 25 PHE CB 1 25 PHE CG -90.00 -150.00 -71.94 -83.03 -49.01 . . 0 "[ . 1 . 2]"
101 CHI1 1 25 PHE N 1 25 PHE CA 1 25 PHE CB 1 25 PHE CG 30.00 -30.00 -71.94 -83.03 -49.01 . . 0 "[ . 1 . 2]"
102 CHI1 1 25 PHE N 1 25 PHE CA 1 25 PHE CB 1 25 PHE CG 150.00 90.00 -71.94 -83.03 -49.01 . . 0 "[ . 1 . 2]"
103 CHI1 1 26 LYS N 1 26 LYS CA 1 26 LYS CB 1 26 LYS CG -90.00 -150.00 -47.39 -75.71 70.34 . . 0 "[ . 1 . 2]"
104 CHI1 1 26 LYS N 1 26 LYS CA 1 26 LYS CB 1 26 LYS CG 30.00 -30.00 -47.39 -75.71 70.34 . . 0 "[ . 1 . 2]"
105 CHI1 1 26 LYS N 1 26 LYS CA 1 26 LYS CB 1 26 LYS CG 150.00 90.00 -47.39 -75.71 70.34 . . 0 "[ . 1 . 2]"
106 CHI2 1 26 LYS CA 1 26 LYS CB 1 26 LYS CG 1 26 LYS CD -90.00 -150.00 -170.15 -159.41 -166.97 1.91 11 0 "[ . 1 . 2]"
107 CHI2 1 26 LYS CA 1 26 LYS CB 1 26 LYS CG 1 26 LYS CD 30.00 -30.00 -170.15 -159.41 -166.97 . . 0 "[ . 1 . 2]"
108 CHI2 1 26 LYS CA 1 26 LYS CB 1 26 LYS CG 1 26 LYS CD 150.00 90.00 -170.15 -159.41 -166.97 . . 0 "[ . 1 . 2]"
109 CHI3 1 26 LYS CB 1 26 LYS CG 1 26 LYS CD 1 26 LYS CE -90.00 -150.00 155.93 161.71 91.64 . . 0 "[ . 1 . 2]"
110 CHI3 1 26 LYS CB 1 26 LYS CG 1 26 LYS CD 1 26 LYS CE 30.00 -30.00 155.93 161.71 91.64 . . 0 "[ . 1 . 2]"
111 CHI3 1 26 LYS CB 1 26 LYS CG 1 26 LYS CD 1 26 LYS CE 150.00 90.00 155.93 161.71 91.64 1.64 11 0 "[ . 1 . 2]"
112 CHI4 1 26 LYS CG 1 26 LYS CD 1 26 LYS CE 1 26 LYS NZ -90.00 -150.00 171.01 -77.49 -88.49 . . 0 "[ . 1 . 2]"
113 CHI4 1 26 LYS CG 1 26 LYS CD 1 26 LYS CE 1 26 LYS NZ 30.00 -30.00 171.01 -77.49 -88.49 . . 0 "[ . 1 . 2]"
114 CHI4 1 26 LYS CG 1 26 LYS CD 1 26 LYS CE 1 26 LYS NZ 150.00 90.00 171.01 -77.49 -88.49 . . 0 "[ . 1 . 2]"
115 CHI1 1 28 ARG N 1 28 ARG CA 1 28 ARG CB 1 28 ARG CG -90.00 -150.00 -76.24 -89.26 -54.68 . . 0 "[ . 1 . 2]"
116 CHI1 1 28 ARG N 1 28 ARG CA 1 28 ARG CB 1 28 ARG CG 30.00 -30.00 -76.24 -89.26 -54.68 . . 0 "[ . 1 . 2]"
117 CHI1 1 28 ARG N 1 28 ARG CA 1 28 ARG CB 1 28 ARG CG 150.00 90.00 -76.24 -89.26 -54.68 . . 0 "[ . 1 . 2]"
118 CHI2 1 28 ARG CA 1 28 ARG CB 1 28 ARG CG 1 28 ARG CD -90.00 -150.00 -155.69 -172.92 -179.30 0.65 7 0 "[ . 1 . 2]"
119 CHI2 1 28 ARG CA 1 28 ARG CB 1 28 ARG CG 1 28 ARG CD 30.00 -30.00 -155.69 -172.92 -179.30 . . 0 "[ . 1 . 2]"
120 CHI2 1 28 ARG CA 1 28 ARG CB 1 28 ARG CG 1 28 ARG CD 150.00 90.00 -155.69 -172.92 -179.30 0.25 11 0 "[ . 1 . 2]"
121 CHI3 1 28 ARG CB 1 28 ARG CG 1 28 ARG CD 1 28 ARG NE -90.00 -150.00 -126.29 82.54 -60.39 . . 0 "[ . 1 . 2]"
122 CHI3 1 28 ARG CB 1 28 ARG CG 1 28 ARG CD 1 28 ARG NE 30.00 -30.00 -126.29 82.54 -60.39 . . 0 "[ . 1 . 2]"
123 CHI3 1 28 ARG CB 1 28 ARG CG 1 28 ARG CD 1 28 ARG NE 150.00 90.00 -126.29 82.54 -60.39 . . 0 "[ . 1 . 2]"
124 CHI1 1 29 ASP N 1 29 ASP CA 1 29 ASP CB 1 29 ASP CG -90.00 -150.00 -120.30 -158.04 -158.58 . . 0 "[ . 1 . 2]"
125 CHI1 1 29 ASP N 1 29 ASP CA 1 29 ASP CB 1 29 ASP CG 30.00 -30.00 -120.30 -158.04 -158.58 . . 0 "[ . 1 . 2]"
126 CHI1 1 29 ASP N 1 29 ASP CA 1 29 ASP CB 1 29 ASP CG 150.00 90.00 -120.30 -158.04 -158.58 . . 0 "[ . 1 . 2]"
127 CHI1 1 30 GLU N 1 30 GLU CA 1 30 GLU CB 1 30 GLU CG -90.00 -150.00 -79.67 -75.93 -78.94 1.47 12 0 "[ . 1 . 2]"
128 CHI1 1 30 GLU N 1 30 GLU CA 1 30 GLU CB 1 30 GLU CG 30.00 -30.00 -79.67 -75.93 -78.94 . . 0 "[ . 1 . 2]"
129 CHI1 1 30 GLU N 1 30 GLU CA 1 30 GLU CB 1 30 GLU CG 150.00 90.00 -79.67 -75.93 -78.94 . . 0 "[ . 1 . 2]"
130 CHI2 1 30 GLU CA 1 30 GLU CB 1 30 GLU CG 1 30 GLU CD -90.00 -150.00 -153.18 40.85 -55.53 . . 0 "[ . 1 . 2]"
131 CHI2 1 30 GLU CA 1 30 GLU CB 1 30 GLU CG 1 30 GLU CD 30.00 -30.00 -153.18 40.85 -55.53 . . 0 "[ . 1 . 2]"
132 CHI2 1 30 GLU CA 1 30 GLU CB 1 30 GLU CG 1 30 GLU CD 150.00 90.00 -153.18 40.85 -55.53 . . 0 "[ . 1 . 2]"
133 CHI1 1 31 LEU N 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG -90.00 -150.00 -53.90 -64.56 -44.27 . . 0 "[ . 1 . 2]"
134 CHI1 1 31 LEU N 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG 30.00 -30.00 -53.90 -64.56 -44.27 . . 0 "[ . 1 . 2]"
135 CHI1 1 31 LEU N 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG 150.00 90.00 -53.90 -64.56 -44.27 . . 0 "[ . 1 . 2]"
136 CHI2 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG 1 31 LEU CD1 -90.00 -150.00 162.65 166.83 164.68 . . 0 "[ . 1 . 2]"
137 CHI2 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG 1 31 LEU CD1 30.00 -30.00 162.65 166.83 164.68 . . 0 "[ . 1 . 2]"
138 CHI2 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG 1 31 LEU CD1 150.00 90.00 162.65 166.83 164.68 . . 0 "[ . 1 . 2]"
139 CHI1 1 33 ILE N 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 -90.00 -150.00 -62.53 -69.97 -58.87 . . 0 "[ . 1 . 2]"
140 CHI1 1 33 ILE N 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 30.00 -30.00 -62.53 -69.97 -58.87 . . 0 "[ . 1 . 2]"
141 CHI1 1 33 ILE N 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 150.00 90.00 -62.53 -69.97 -58.87 . . 0 "[ . 1 . 2]"
142 CHI21 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 1 33 ILE CD1 -90.00 -150.00 134.11 155.80 90.98 . . 0 "[ . 1 . 2]"
143 CHI21 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 1 33 ILE CD1 30.00 -30.00 134.11 155.80 90.98 . . 0 "[ . 1 . 2]"
144 CHI21 1 33 ILE CA 1 33 ILE CB 1 33 ILE CG1 1 33 ILE CD1 150.00 90.00 134.11 155.80 90.98 0.98 3 0 "[ . 1 . 2]"
145 CHI1 1 34 CYS N 1 34 CYS CA 1 34 CYS CB 1 34 CYS SG -90.00 -150.00 -86.06 -79.26 -86.75 2.08 17 0 "[ . 1 . 2]"
146 CHI1 1 34 CYS N 1 34 CYS CA 1 34 CYS CB 1 34 CYS SG 30.00 -30.00 -86.06 -79.26 -86.75 . . 0 "[ . 1 . 2]"
147 CHI1 1 34 CYS N 1 34 CYS CA 1 34 CYS CB 1 34 CYS SG 150.00 90.00 -86.06 -79.26 -86.75 . . 0 "[ . 1 . 2]"
148 CHI1 1 36 CYS N 1 36 CYS CA 1 36 CYS CB 1 36 CYS SG -90.00 -150.00 55.34 57.45 56.41 . . 0 "[ . 1 . 2]"
149 CHI1 1 36 CYS N 1 36 CYS CA 1 36 CYS CB 1 36 CYS SG 30.00 -30.00 55.34 57.45 56.41 . . 0 "[ . 1 . 2]"
150 CHI1 1 36 CYS N 1 36 CYS CA 1 36 CYS CB 1 36 CYS SG 150.00 90.00 55.34 57.45 56.41 . . 0 "[ . 1 . 2]"
151 CHI1 1 37 LYS N 1 37 LYS CA 1 37 LYS CB 1 37 LYS CG -90.00 -150.00 -71.55 -89.98 -58.27 . . 0 "[ . 1 . 2]"
152 CHI1 1 37 LYS N 1 37 LYS CA 1 37 LYS CB 1 37 LYS CG 30.00 -30.00 -71.55 -89.98 -58.27 . . 0 "[ . 1 . 2]"
153 CHI1 1 37 LYS N 1 37 LYS CA 1 37 LYS CB 1 37 LYS CG 150.00 90.00 -71.55 -89.98 -58.27 . . 0 "[ . 1 . 2]"
154 CHI2 1 37 LYS CA 1 37 LYS CB 1 37 LYS CG 1 37 LYS CD -90.00 -150.00 -79.07 78.27 -66.93 2.82 6 0 "[ . 1 . 2]"
155 CHI2 1 37 LYS CA 1 37 LYS CB 1 37 LYS CG 1 37 LYS CD 30.00 -30.00 -79.07 78.27 -66.93 . . 0 "[ . 1 . 2]"
156 CHI2 1 37 LYS CA 1 37 LYS CB 1 37 LYS CG 1 37 LYS CD 150.00 90.00 -79.07 78.27 -66.93 0.18 10 0 "[ . 1 . 2]"
157 CHI3 1 37 LYS CB 1 37 LYS CG 1 37 LYS CD 1 37 LYS CE -90.00 -150.00 177.01 90.13 -74.06 0.92 9 0 "[ . 1 . 2]"
158 CHI3 1 37 LYS CB 1 37 LYS CG 1 37 LYS CD 1 37 LYS CE 30.00 -30.00 177.01 90.13 -74.06 . . 0 "[ . 1 . 2]"
159 CHI3 1 37 LYS CB 1 37 LYS CG 1 37 LYS CD 1 37 LYS CE 150.00 90.00 177.01 90.13 -74.06 6.38 6 2 "[ .+ - 1 . 2]"
160 CHI4 1 37 LYS CG 1 37 LYS CD 1 37 LYS CE 1 37 LYS NZ -90.00 -150.00 154.30 64.57 -62.46 2.10 18 0 "[ . 1 . 2]"
161 CHI4 1 37 LYS CG 1 37 LYS CD 1 37 LYS CE 1 37 LYS NZ 30.00 -30.00 154.30 64.57 -62.46 . . 0 "[ . 1 . 2]"
162 CHI4 1 37 LYS CG 1 37 LYS CD 1 37 LYS CE 1 37 LYS NZ 150.00 90.00 154.30 64.57 -62.46 2.24 8 0 "[ . 1 . 2]"
163 CHI1 1 38 HIS N 1 38 HIS CA 1 38 HIS CB 1 38 HIS CG -90.00 -150.00 -80.61 -90.06 -73.20 0.06 16 0 "[ . 1 . 2]"
164 CHI1 1 38 HIS N 1 38 HIS CA 1 38 HIS CB 1 38 HIS CG 30.00 -30.00 -80.61 -90.06 -73.20 . . 0 "[ . 1 . 2]"
165 CHI1 1 38 HIS N 1 38 HIS CA 1 38 HIS CB 1 38 HIS CG 150.00 90.00 -80.61 -90.06 -73.20 . . 0 "[ . 1 . 2]"
166 CHI1 1 40 PHE N 1 40 PHE CA 1 40 PHE CB 1 40 PHE CG -90.00 -150.00 -57.03 -65.16 -47.05 . . 0 "[ . 1 . 2]"
167 CHI1 1 40 PHE N 1 40 PHE CA 1 40 PHE CB 1 40 PHE CG 30.00 -30.00 -57.03 -65.16 -47.05 . . 0 "[ . 1 . 2]"
168 CHI1 1 40 PHE N 1 40 PHE CA 1 40 PHE CB 1 40 PHE CG 150.00 90.00 -57.03 -65.16 -47.05 . . 0 "[ . 1 . 2]"
169 CHI1 1 41 HIS N 1 41 HIS CA 1 41 HIS CB 1 41 HIS CG -90.00 -150.00 -70.49 -71.41 -72.99 . . 0 "[ . 1 . 2]"
170 CHI1 1 41 HIS N 1 41 HIS CA 1 41 HIS CB 1 41 HIS CG 30.00 -30.00 -70.49 -71.41 -72.99 . . 0 "[ . 1 . 2]"
171 CHI1 1 41 HIS N 1 41 HIS CA 1 41 HIS CB 1 41 HIS CG 150.00 90.00 -70.49 -71.41 -72.99 . . 0 "[ . 1 . 2]"
172 CHI1 1 42 ARG N 1 42 ARG CA 1 42 ARG CB 1 42 ARG CG -90.00 -150.00 -84.63 -76.53 -80.61 0.65 11 0 "[ . 1 . 2]"
173 CHI1 1 42 ARG N 1 42 ARG CA 1 42 ARG CB 1 42 ARG CG 30.00 -30.00 -84.63 -76.53 -80.61 . . 0 "[ . 1 . 2]"
174 CHI1 1 42 ARG N 1 42 ARG CA 1 42 ARG CB 1 42 ARG CG 150.00 90.00 -84.63 -76.53 -80.61 . . 0 "[ . 1 . 2]"
175 CHI2 1 42 ARG CA 1 42 ARG CB 1 42 ARG CG 1 42 ARG CD -90.00 -150.00 -95.97 -84.55 -88.44 1.94 11 0 "[ . 1 . 2]"
176 CHI2 1 42 ARG CA 1 42 ARG CB 1 42 ARG CG 1 42 ARG CD 30.00 -30.00 -95.97 -84.55 -88.44 . . 0 "[ . 1 . 2]"
177 CHI2 1 42 ARG CA 1 42 ARG CB 1 42 ARG CG 1 42 ARG CD 150.00 90.00 -95.97 -84.55 -88.44 . . 0 "[ . 1 . 2]"
178 CHI3 1 42 ARG CB 1 42 ARG CG 1 42 ARG CD 1 42 ARG NE -90.00 -150.00 147.85 163.88 91.34 0.68 18 0 "[ . 1 . 2]"
179 CHI3 1 42 ARG CB 1 42 ARG CG 1 42 ARG CD 1 42 ARG NE 30.00 -30.00 147.85 163.88 91.34 . . 0 "[ . 1 . 2]"
180 CHI3 1 42 ARG CB 1 42 ARG CG 1 42 ARG CD 1 42 ARG NE 150.00 90.00 147.85 163.88 91.34 1.34 4 0 "[ . 1 . 2]"
181 CHI1 1 43 LYS N 1 43 LYS CA 1 43 LYS CB 1 43 LYS CG -90.00 -150.00 -170.84 -74.73 -151.05 . . 0 "[ . 1 . 2]"
182 CHI1 1 43 LYS N 1 43 LYS CA 1 43 LYS CB 1 43 LYS CG 30.00 -30.00 -170.84 -74.73 -151.05 . . 0 "[ . 1 . 2]"
183 CHI1 1 43 LYS N 1 43 LYS CA 1 43 LYS CB 1 43 LYS CG 150.00 90.00 -170.84 -74.73 -151.05 . . 0 "[ . 1 . 2]"
184 CHI2 1 43 LYS CA 1 43 LYS CB 1 43 LYS CG 1 43 LYS CD -90.00 -150.00 173.10 -85.15 -155.69 . . 0 "[ . 1 . 2]"
185 CHI2 1 43 LYS CA 1 43 LYS CB 1 43 LYS CG 1 43 LYS CD 30.00 -30.00 173.10 -85.15 -155.69 . . 0 "[ . 1 . 2]"
186 CHI2 1 43 LYS CA 1 43 LYS CB 1 43 LYS CG 1 43 LYS CD 150.00 90.00 173.10 -85.15 -155.69 . . 0 "[ . 1 . 2]"
187 CHI3 1 43 LYS CB 1 43 LYS CG 1 43 LYS CD 1 43 LYS CE -90.00 -150.00 -160.00 160.50 88.83 . . 0 "[ . 1 . 2]"
188 CHI3 1 43 LYS CB 1 43 LYS CG 1 43 LYS CD 1 43 LYS CE 30.00 -30.00 -160.00 160.50 88.83 . . 0 "[ . 1 . 2]"
189 CHI3 1 43 LYS CB 1 43 LYS CG 1 43 LYS CD 1 43 LYS CE 150.00 90.00 -160.00 160.50 88.83 . . 0 "[ . 1 . 2]"
190 CHI4 1 43 LYS CG 1 43 LYS CD 1 43 LYS CE 1 43 LYS NZ -90.00 -150.00 -170.90 -81.37 -151.27 . . 0 "[ . 1 . 2]"
191 CHI4 1 43 LYS CG 1 43 LYS CD 1 43 LYS CE 1 43 LYS NZ 30.00 -30.00 -170.90 -81.37 -151.27 . . 0 "[ . 1 . 2]"
192 CHI4 1 43 LYS CG 1 43 LYS CD 1 43 LYS CE 1 43 LYS NZ 150.00 90.00 -170.90 -81.37 -151.27 . . 0 "[ . 1 . 2]"
193 CHI1 1 44 CYS N 1 44 CYS CA 1 44 CYS CB 1 44 CYS SG -90.00 -150.00 -71.70 -78.73 -66.87 . . 0 "[ . 1 . 2]"
194 CHI1 1 44 CYS N 1 44 CYS CA 1 44 CYS CB 1 44 CYS SG 30.00 -30.00 -71.70 -78.73 -66.87 . . 0 "[ . 1 . 2]"
195 CHI1 1 44 CYS N 1 44 CYS CA 1 44 CYS CB 1 44 CYS SG 150.00 90.00 -71.70 -78.73 -66.87 . . 0 "[ . 1 . 2]"
196 CHI1 1 45 LEU N 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG -90.00 -150.00 -159.67 -152.23 -154.87 . . 0 "[ . 1 . 2]"
197 CHI1 1 45 LEU N 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG 30.00 -30.00 -159.67 -152.23 -154.87 . . 0 "[ . 1 . 2]"
198 CHI1 1 45 LEU N 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG 150.00 90.00 -159.67 -152.23 -154.87 . . 0 "[ . 1 . 2]"
199 CHI2 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG 1 45 LEU CD1 -90.00 -150.00 64.28 67.01 64.74 . . 0 "[ . 1 . 2]"
200 CHI2 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG 1 45 LEU CD1 30.00 -30.00 64.28 67.01 64.74 . . 0 "[ . 1 . 2]"
201 CHI2 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG 1 45 LEU CD1 150.00 90.00 64.28 67.01 64.74 . . 0 "[ . 1 . 2]"
202 CHI1 1 46 ILE N 1 46 ILE CA 1 46 ILE CB 1 46 ILE CG1 -90.00 -150.00 -65.23 -63.87 -64.88 . . 0 "[ . 1 . 2]"
203 CHI1 1 46 ILE N 1 46 ILE CA 1 46 ILE CB 1 46 ILE CG1 30.00 -30.00 -65.23 -63.87 -64.88 . . 0 "[ . 1 . 2]"
204 CHI1 1 46 ILE N 1 46 ILE CA 1 46 ILE CB 1 46 ILE CG1 150.00 90.00 -65.23 -63.87 -64.88 . . 0 "[ . 1 . 2]"
205 CHI21 1 46 ILE CA 1 46 ILE CB 1 46 ILE CG1 1 46 ILE CD1 -90.00 -150.00 162.36 160.76 159.62 . . 0 "[ . 1 . 2]"
206 CHI21 1 46 ILE CA 1 46 ILE CB 1 46 ILE CG1 1 46 ILE CD1 30.00 -30.00 162.36 160.76 159.62 . . 0 "[ . 1 . 2]"
207 CHI21 1 46 ILE CA 1 46 ILE CB 1 46 ILE CG1 1 46 ILE CD1 150.00 90.00 162.36 160.76 159.62 . . 0 "[ . 1 . 2]"
208 CHI1 1 47 LYS N 1 47 LYS CA 1 47 LYS CB 1 47 LYS CG -90.00 -150.00 -137.86 177.55 -58.75 2.70 19 0 "[ . 1 . 2]"
209 CHI1 1 47 LYS N 1 47 LYS CA 1 47 LYS CB 1 47 LYS CG 30.00 -30.00 -137.86 177.55 -58.75 . . 0 "[ . 1 . 2]"
210 CHI1 1 47 LYS N 1 47 LYS CA 1 47 LYS CB 1 47 LYS CG 150.00 90.00 -137.86 177.55 -58.75 . . 0 "[ . 1 . 2]"
211 CHI2 1 47 LYS CA 1 47 LYS CB 1 47 LYS CG 1 47 LYS CD -90.00 -150.00 -141.34 -90.29 -146.48 3.52 19 0 "[ . 1 . 2]"
212 CHI2 1 47 LYS CA 1 47 LYS CB 1 47 LYS CG 1 47 LYS CD 30.00 -30.00 -141.34 -90.29 -146.48 . . 0 "[ . 1 . 2]"
213 CHI2 1 47 LYS CA 1 47 LYS CB 1 47 LYS CG 1 47 LYS CD 150.00 90.00 -141.34 -90.29 -146.48 4.47 18 0 "[ . 1 . 2]"
214 CHI3 1 47 LYS CB 1 47 LYS CG 1 47 LYS CD 1 47 LYS CE -90.00 -150.00 -164.01 75.57 -81.80 6.56 12 2 "[ . 1 + . - 2]"
215 CHI3 1 47 LYS CB 1 47 LYS CG 1 47 LYS CD 1 47 LYS CE 30.00 -30.00 -164.01 75.57 -81.80 . . 0 "[ . 1 . 2]"
216 CHI3 1 47 LYS CB 1 47 LYS CG 1 47 LYS CD 1 47 LYS CE 150.00 90.00 -164.01 75.57 -81.80 . . 0 "[ . 1 . 2]"
217 CHI4 1 47 LYS CG 1 47 LYS CD 1 47 LYS CE 1 47 LYS NZ -90.00 -150.00 157.06 64.43 -70.37 . . 0 "[ . 1 . 2]"
218 CHI4 1 47 LYS CG 1 47 LYS CD 1 47 LYS CE 1 47 LYS NZ 30.00 -30.00 157.06 64.43 -70.37 . . 0 "[ . 1 . 2]"
219 CHI4 1 47 LYS CG 1 47 LYS CD 1 47 LYS CE 1 47 LYS NZ 150.00 90.00 157.06 64.43 -70.37 . . 0 "[ . 1 . 2]"
220 CHI1 1 48 TRP N 1 48 TRP CA 1 48 TRP CB 1 48 TRP CG -90.00 -150.00 177.26 169.28 -175.45 . . 0 "[ . 1 . 2]"
221 CHI1 1 48 TRP N 1 48 TRP CA 1 48 TRP CB 1 48 TRP CG 30.00 -30.00 177.26 169.28 -175.45 . . 0 "[ . 1 . 2]"
222 CHI1 1 48 TRP N 1 48 TRP CA 1 48 TRP CB 1 48 TRP CG 150.00 90.00 177.26 169.28 -175.45 . . 0 "[ . 1 . 2]"
223 CHI1 1 49 LEU N 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG -90.00 -150.00 -69.72 -72.98 -75.54 . . 0 "[ . 1 . 2]"
224 CHI1 1 49 LEU N 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG 30.00 -30.00 -69.72 -72.98 -75.54 . . 0 "[ . 1 . 2]"
225 CHI1 1 49 LEU N 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG 150.00 90.00 -69.72 -72.98 -75.54 . . 0 "[ . 1 . 2]"
226 CHI2 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG 1 49 LEU CD1 -90.00 -150.00 166.32 163.09 161.67 . . 0 "[ . 1 . 2]"
227 CHI2 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG 1 49 LEU CD1 30.00 -30.00 166.32 163.09 161.67 . . 0 "[ . 1 . 2]"
228 CHI2 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG 1 49 LEU CD1 150.00 90.00 166.32 163.09 161.67 . . 0 "[ . 1 . 2]"
229 CHI1 1 50 GLU N 1 50 GLU CA 1 50 GLU CB 1 50 GLU CG -90.00 -150.00 -70.14 -82.65 -53.08 . . 0 "[ . 1 . 2]"
230 CHI1 1 50 GLU N 1 50 GLU CA 1 50 GLU CB 1 50 GLU CG 30.00 -30.00 -70.14 -82.65 -53.08 . . 0 "[ . 1 . 2]"
231 CHI1 1 50 GLU N 1 50 GLU CA 1 50 GLU CB 1 50 GLU CG 150.00 90.00 -70.14 -82.65 -53.08 . . 0 "[ . 1 . 2]"
232 CHI2 1 50 GLU CA 1 50 GLU CB 1 50 GLU CG 1 50 GLU CD -90.00 -150.00 -98.99 -55.74 -73.20 0.00 15 0 "[ . 1 . 2]"
233 CHI2 1 50 GLU CA 1 50 GLU CB 1 50 GLU CG 1 50 GLU CD 30.00 -30.00 -98.99 -55.74 -73.20 . . 0 "[ . 1 . 2]"
234 CHI2 1 50 GLU CA 1 50 GLU CB 1 50 GLU CG 1 50 GLU CD 150.00 90.00 -98.99 -55.74 -73.20 . . 0 "[ . 1 . 2]"
235 CHI1 1 51 VAL N 1 51 VAL CA 1 51 VAL CB 1 51 VAL CG1 -90.00 -150.00 -31.19 56.26 -61.59 . . 0 "[ . 1 . 2]"
236 CHI1 1 51 VAL N 1 51 VAL CA 1 51 VAL CB 1 51 VAL CG1 30.00 -30.00 -31.19 56.26 -61.59 . . 0 "[ . 1 . 2]"
237 CHI1 1 51 VAL N 1 51 VAL CA 1 51 VAL CB 1 51 VAL CG1 150.00 90.00 -31.19 56.26 -61.59 . . 0 "[ . 1 . 2]"
238 CHI1 1 52 ARG N 1 52 ARG CA 1 52 ARG CB 1 52 ARG CG -90.00 -150.00 -95.77 -89.18 -90.36 3.90 7 0 "[ . 1 . 2]"
239 CHI1 1 52 ARG N 1 52 ARG CA 1 52 ARG CB 1 52 ARG CG 30.00 -30.00 -95.77 -89.18 -90.36 . . 0 "[ . 1 . 2]"
240 CHI1 1 52 ARG N 1 52 ARG CA 1 52 ARG CB 1 52 ARG CG 150.00 90.00 -95.77 -89.18 -90.36 . . 0 "[ . 1 . 2]"
241 CHI2 1 52 ARG CA 1 52 ARG CB 1 52 ARG CG 1 52 ARG CD -90.00 -150.00 -173.98 150.72 -89.66 0.96 15 0 "[ . 1 . 2]"
242 CHI2 1 52 ARG CA 1 52 ARG CB 1 52 ARG CG 1 52 ARG CD 30.00 -30.00 -173.98 150.72 -89.66 . . 0 "[ . 1 . 2]"
243 CHI2 1 52 ARG CA 1 52 ARG CB 1 52 ARG CG 1 52 ARG CD 150.00 90.00 -173.98 150.72 -89.66 . . 0 "[ . 1 . 2]"
244 CHI3 1 52 ARG CB 1 52 ARG CG 1 52 ARG CD 1 52 ARG NE -90.00 -150.00 -142.06 -160.12 -161.85 . . 0 "[ . 1 . 2]"
245 CHI3 1 52 ARG CB 1 52 ARG CG 1 52 ARG CD 1 52 ARG NE 30.00 -30.00 -142.06 -160.12 -161.85 . . 0 "[ . 1 . 2]"
246 CHI3 1 52 ARG CB 1 52 ARG CG 1 52 ARG CD 1 52 ARG NE 150.00 90.00 -142.06 -160.12 -161.85 0.13 18 0 "[ . 1 . 2]"
247 CHI1 1 53 LYS N 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG -90.00 -150.00 -77.34 -64.67 -66.88 . . 0 "[ . 1 . 2]"
248 CHI1 1 53 LYS N 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG 30.00 -30.00 -77.34 -64.67 -66.88 . . 0 "[ . 1 . 2]"
249 CHI1 1 53 LYS N 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG 150.00 90.00 -77.34 -64.67 -66.88 . . 0 "[ . 1 . 2]"
250 CHI2 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG 1 53 LYS CD -90.00 -150.00 171.66 75.72 -81.77 3.13 20 0 "[ . 1 . 2]"
251 CHI2 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG 1 53 LYS CD 30.00 -30.00 171.66 75.72 -81.77 . . 0 "[ . 1 . 2]"
252 CHI2 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG 1 53 LYS CD 150.00 90.00 171.66 75.72 -81.77 . . 0 "[ . 1 . 2]"
253 CHI3 1 53 LYS CB 1 53 LYS CG 1 53 LYS CD 1 53 LYS CE -90.00 -150.00 -169.44 71.79 -78.31 5.22 13 1 "[ . 1 + . 2]"
254 CHI3 1 53 LYS CB 1 53 LYS CG 1 53 LYS CD 1 53 LYS CE 30.00 -30.00 -169.44 71.79 -78.31 . . 0 "[ . 1 . 2]"
255 CHI3 1 53 LYS CB 1 53 LYS CG 1 53 LYS CD 1 53 LYS CE 150.00 90.00 -169.44 71.79 -78.31 . . 0 "[ . 1 . 2]"
256 CHI4 1 53 LYS CG 1 53 LYS CD 1 53 LYS CE 1 53 LYS NZ -90.00 -150.00 -108.63 63.45 -62.68 0.71 13 0 "[ . 1 . 2]"
257 CHI4 1 53 LYS CG 1 53 LYS CD 1 53 LYS CE 1 53 LYS NZ 30.00 -30.00 -108.63 63.45 -62.68 . . 0 "[ . 1 . 2]"
258 CHI4 1 53 LYS CG 1 53 LYS CD 1 53 LYS CE 1 53 LYS NZ 150.00 90.00 -108.63 63.45 -62.68 . . 0 "[ . 1 . 2]"
259 CHI1 1 54 VAL N 1 54 VAL CA 1 54 VAL CB 1 54 VAL CG1 -90.00 -150.00 -58.46 -64.24 -45.52 . . 0 "[ . 1 . 2]"
260 CHI1 1 54 VAL N 1 54 VAL CA 1 54 VAL CB 1 54 VAL CG1 30.00 -30.00 -58.46 -64.24 -45.52 . . 0 "[ . 1 . 2]"
261 CHI1 1 54 VAL N 1 54 VAL CA 1 54 VAL CB 1 54 VAL CG1 150.00 90.00 -58.46 -64.24 -45.52 . . 0 "[ . 1 . 2]"
262 CHI1 1 55 CYS N 1 55 CYS CA 1 55 CYS CB 1 55 CYS SG -90.00 -150.00 -168.06 -166.03 -168.63 . . 0 "[ . 1 . 2]"
263 CHI1 1 55 CYS N 1 55 CYS CA 1 55 CYS CB 1 55 CYS SG 30.00 -30.00 -168.06 -166.03 -168.63 . . 0 "[ . 1 . 2]"
264 CHI1 1 55 CYS N 1 55 CYS CA 1 55 CYS CB 1 55 CYS SG 150.00 90.00 -168.06 -166.03 -168.63 . . 0 "[ . 1 . 2]"
265 CHI1 1 57 LEU N 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG -90.00 -150.00 -84.57 -87.96 -88.61 0.01 5 0 "[ . 1 . 2]"
266 CHI1 1 57 LEU N 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG 30.00 -30.00 -84.57 -87.96 -88.61 . . 0 "[ . 1 . 2]"
267 CHI1 1 57 LEU N 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG 150.00 90.00 -84.57 -87.96 -88.61 . . 0 "[ . 1 . 2]"
268 CHI2 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG 1 57 LEU CD1 -90.00 -150.00 173.15 167.27 -179.93 . . 0 "[ . 1 . 2]"
269 CHI2 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG 1 57 LEU CD1 30.00 -30.00 173.15 167.27 -179.93 . . 0 "[ . 1 . 2]"
270 CHI2 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG 1 57 LEU CD1 150.00 90.00 173.15 167.27 -179.93 . . 0 "[ . 1 . 2]"
271 CHI1 1 58 CYS N 1 58 CYS CA 1 58 CYS CB 1 58 CYS SG -90.00 -150.00 56.06 54.76 52.63 . . 0 "[ . 1 . 2]"
272 CHI1 1 58 CYS N 1 58 CYS CA 1 58 CYS CB 1 58 CYS SG 30.00 -30.00 56.06 54.76 52.63 . . 0 "[ . 1 . 2]"
273 CHI1 1 58 CYS N 1 58 CYS CA 1 58 CYS CB 1 58 CYS SG 150.00 90.00 56.06 54.76 52.63 . . 0 "[ . 1 . 2]"
274 CHI1 1 59 ASN N 1 59 ASN CA 1 59 ASN CB 1 59 ASN CG -90.00 -150.00 -140.38 177.92 69.75 0.24 18 0 "[ . 1 . 2]"
275 CHI1 1 59 ASN N 1 59 ASN CA 1 59 ASN CB 1 59 ASN CG 30.00 -30.00 -140.38 177.92 69.75 . . 0 "[ . 1 . 2]"
276 CHI1 1 59 ASN N 1 59 ASN CA 1 59 ASN CB 1 59 ASN CG 150.00 90.00 -140.38 177.92 69.75 . . 0 "[ . 1 . 2]"
277 CHI1 1 60 MET N 1 60 MET CA 1 60 MET CB 1 60 MET CG -90.00 -150.00 -135.38 -89.84 -148.27 1.73 18 0 "[ . 1 . 2]"
278 CHI1 1 60 MET N 1 60 MET CA 1 60 MET CB 1 60 MET CG 30.00 -30.00 -135.38 -89.84 -148.27 . . 0 "[ . 1 . 2]"
279 CHI1 1 60 MET N 1 60 MET CA 1 60 MET CB 1 60 MET CG 150.00 90.00 -135.38 -89.84 -148.27 . . 0 "[ . 1 . 2]"
280 CHI2 1 60 MET CA 1 60 MET CB 1 60 MET CG 1 60 MET SD -90.00 -150.00 -133.38 -88.22 -161.04 . . 0 "[ . 1 . 2]"
281 CHI2 1 60 MET CA 1 60 MET CB 1 60 MET CG 1 60 MET SD 30.00 -30.00 -133.38 -88.22 -161.04 . . 0 "[ . 1 . 2]"
282 CHI2 1 60 MET CA 1 60 MET CB 1 60 MET CG 1 60 MET SD 150.00 90.00 -133.38 -88.22 -161.04 2.92 13 0 "[ . 1 . 2]"
283 CHI1 1 62 VAL N 1 62 VAL CA 1 62 VAL CB 1 62 VAL CG1 -90.00 -150.00 -176.98 48.08 -72.30 . . 0 "[ . 1 . 2]"
284 CHI1 1 62 VAL N 1 62 VAL CA 1 62 VAL CB 1 62 VAL CG1 30.00 -30.00 -176.98 48.08 -72.30 . . 0 "[ . 1 . 2]"
285 CHI1 1 62 VAL N 1 62 VAL CA 1 62 VAL CB 1 62 VAL CG1 150.00 90.00 -176.98 48.08 -72.30 . . 0 "[ . 1 . 2]"
286 CHI1 1 63 LEU N 1 63 LEU CA 1 63 LEU CB 1 63 LEU CG -90.00 -150.00 -89.04 172.71 -49.82 7.69 17 1 "[ . 1 . + 2]"
287 CHI1 1 63 LEU N 1 63 LEU CA 1 63 LEU CB 1 63 LEU CG 30.00 -30.00 -89.04 172.71 -49.82 . . 0 "[ . 1 . 2]"
288 CHI1 1 63 LEU N 1 63 LEU CA 1 63 LEU CB 1 63 LEU CG 150.00 90.00 -89.04 172.71 -49.82 . . 0 "[ . 1 . 2]"
289 CHI2 1 63 LEU CA 1 63 LEU CB 1 63 LEU CG 1 63 LEU CD1 -90.00 -150.00 127.62 76.43 73.63 . . 0 "[ . 1 . 2]"
290 CHI2 1 63 LEU CA 1 63 LEU CB 1 63 LEU CG 1 63 LEU CD1 30.00 -30.00 127.62 76.43 73.63 . . 0 "[ . 1 . 2]"
291 CHI2 1 63 LEU CA 1 63 LEU CB 1 63 LEU CG 1 63 LEU CD1 150.00 90.00 127.62 76.43 73.63 2.45 17 0 "[ . 1 . 2]"
292 CHI1 1 64 GLN N 1 64 GLN CA 1 64 GLN CB 1 64 GLN CG -90.00 -150.00 -161.56 176.68 72.15 0.80 15 0 "[ . 1 . 2]"
293 CHI1 1 64 GLN N 1 64 GLN CA 1 64 GLN CB 1 64 GLN CG 30.00 -30.00 -161.56 176.68 72.15 . . 0 "[ . 1 . 2]"
294 CHI1 1 64 GLN N 1 64 GLN CA 1 64 GLN CB 1 64 GLN CG 150.00 90.00 -161.56 176.68 72.15 . . 0 "[ . 1 . 2]"
295 CHI2 1 64 GLN CA 1 64 GLN CB 1 64 GLN CG 1 64 GLN CD -90.00 -150.00 146.28 53.92 -58.21 . . 0 "[ . 1 . 2]"
296 CHI2 1 64 GLN CA 1 64 GLN CB 1 64 GLN CG 1 64 GLN CD 30.00 -30.00 146.28 53.92 -58.21 . . 0 "[ . 1 . 2]"
297 CHI2 1 64 GLN CA 1 64 GLN CB 1 64 GLN CG 1 64 GLN CD 150.00 90.00 146.28 53.92 -58.21 . . 0 "[ . 1 . 2]"
298 CHI1 1 65 LEU N 1 65 LEU CA 1 65 LEU CB 1 65 LEU CG -90.00 -150.00 -130.46 -62.44 -67.28 0.22 13 0 "[ . 1 . 2]"
299 CHI1 1 65 LEU N 1 65 LEU CA 1 65 LEU CB 1 65 LEU CG 30.00 -30.00 -130.46 -62.44 -67.28 . . 0 "[ . 1 . 2]"
300 CHI1 1 65 LEU N 1 65 LEU CA 1 65 LEU CB 1 65 LEU CG 150.00 90.00 -130.46 -62.44 -67.28 . . 0 "[ . 1 . 2]"
301 CHI2 1 65 LEU CA 1 65 LEU CB 1 65 LEU CG 1 65 LEU CD1 -90.00 -150.00 115.25 148.58 89.56 . . 0 "[ . 1 . 2]"
302 CHI2 1 65 LEU CA 1 65 LEU CB 1 65 LEU CG 1 65 LEU CD1 30.00 -30.00 115.25 148.58 89.56 . . 0 "[ . 1 . 2]"
303 CHI2 1 65 LEU CA 1 65 LEU CB 1 65 LEU CG 1 65 LEU CD1 150.00 90.00 115.25 148.58 89.56 1.42 19 0 "[ . 1 . 2]"
304 CHI1 1 67 GLN N 1 67 GLN CA 1 67 GLN CB 1 67 GLN CG -90.00 -150.00 -128.73 -82.85 -150.16 . . 0 "[ . 1 . 2]"
305 CHI1 1 67 GLN N 1 67 GLN CA 1 67 GLN CB 1 67 GLN CG 30.00 -30.00 -128.73 -82.85 -150.16 . . 0 "[ . 1 . 2]"
306 CHI1 1 67 GLN N 1 67 GLN CA 1 67 GLN CB 1 67 GLN CG 150.00 90.00 -128.73 -82.85 -150.16 . . 0 "[ . 1 . 2]"
307 CHI2 1 67 GLN CA 1 67 GLN CB 1 67 GLN CG 1 67 GLN CD -90.00 -150.00 -157.98 58.33 -54.70 . . 0 "[ . 1 . 2]"
308 CHI2 1 67 GLN CA 1 67 GLN CB 1 67 GLN CG 1 67 GLN CD 30.00 -30.00 -157.98 58.33 -54.70 . . 0 "[ . 1 . 2]"
309 CHI2 1 67 GLN CA 1 67 GLN CB 1 67 GLN CG 1 67 GLN CD 150.00 90.00 -157.98 58.33 -54.70 . . 0 "[ . 1 . 2]"
310 CHI1 1 68 LEU N 1 68 LEU CA 1 68 LEU CB 1 68 LEU CG -90.00 -150.00 -38.26 -56.23 -65.57 . . 0 "[ . 1 . 2]"
311 CHI1 1 68 LEU N 1 68 LEU CA 1 68 LEU CB 1 68 LEU CG 30.00 -30.00 -38.26 -56.23 -65.57 . . 0 "[ . 1 . 2]"
312 CHI1 1 68 LEU N 1 68 LEU CA 1 68 LEU CB 1 68 LEU CG 150.00 90.00 -38.26 -56.23 -65.57 . . 0 "[ . 1 . 2]"
313 CHI2 1 68 LEU CA 1 68 LEU CB 1 68 LEU CG 1 68 LEU CD1 -90.00 -150.00 124.62 159.56 156.52 . . 0 "[ . 1 . 2]"
314 CHI2 1 68 LEU CA 1 68 LEU CB 1 68 LEU CG 1 68 LEU CD1 30.00 -30.00 124.62 159.56 156.52 . . 0 "[ . 1 . 2]"
315 CHI2 1 68 LEU CA 1 68 LEU CB 1 68 LEU CG 1 68 LEU CD1 150.00 90.00 124.62 159.56 156.52 0.39 11 0 "[ . 1 . 2]"
316 CHI1 1 69 SER N 1 69 SER CA 1 69 SER CB 1 69 SER OG -90.00 -150.00 -79.05 52.27 -64.96 . . 0 "[ . 1 . 2]"
317 CHI1 1 69 SER N 1 69 SER CA 1 69 SER CB 1 69 SER OG 30.00 -30.00 -79.05 52.27 -64.96 . . 0 "[ . 1 . 2]"
318 CHI1 1 69 SER N 1 69 SER CA 1 69 SER CB 1 69 SER OG 150.00 90.00 -79.05 52.27 -64.96 . . 0 "[ . 1 . 2]"
319 CHI1 1 72 SER N 1 72 SER CA 1 72 SER CB 1 72 SER OG -90.00 -150.00 -73.23 -88.29 -157.48 . . 0 "[ . 1 . 2]"
320 CHI1 1 72 SER N 1 72 SER CA 1 72 SER CB 1 72 SER OG 30.00 -30.00 -73.23 -88.29 -157.48 . . 0 "[ . 1 . 2]"
321 CHI1 1 72 SER N 1 72 SER CA 1 72 SER CB 1 72 SER OG 150.00 90.00 -73.23 -88.29 -157.48 . . 0 "[ . 1 . 2]"
322 CHI1 1 73 SER N 1 73 SER CA 1 73 SER CB 1 73 SER OG -90.00 -150.00 -101.36 -89.11 -159.63 . . 0 "[ . 1 . 2]"
323 CHI1 1 73 SER N 1 73 SER CA 1 73 SER CB 1 73 SER OG 30.00 -30.00 -101.36 -89.11 -159.63 . . 0 "[ . 1 . 2]"
324 CHI1 1 73 SER N 1 73 SER CA 1 73 SER CB 1 73 SER OG 150.00 90.00 -101.36 -89.11 -159.63 . . 0 "[ . 1 . 2]"
stop_
save_
save_dihedral_constraint_statistics_2
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 61
_TA_constraint_stats_list.Viol_count 33
_TA_constraint_stats_list.Viol_total 124.06
_TA_constraint_stats_list.Viol_max 0.65
_TA_constraint_stats_list.Viol_rms 0.04
_TA_constraint_stats_list.Viol_average_all_restraints 0.01
_TA_constraint_stats_list.Viol_average_violations_only 0.19
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details .
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 CHI1 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG -90.00 -30.00 -46.78 -61.35 -29.88 0.12 9 0 "[ . 1 . 2]"
2 CHI1 1 18 CYS N 1 18 CYS CA 1 18 CYS CB 1 18 CYS SG 150.00 -150.00 -172.33 176.54 -165.52 . . 0 "[ . 1 . 2]"
3 CHI1 1 21 CYS N 1 21 CYS CA 1 21 CYS CB 1 21 CYS SG 30.00 90.00 68.11 60.38 76.70 . . 0 "[ . 1 . 2]"
4 CHI1 1 22 LEU N 1 22 LEU CA 1 22 LEU CB 1 22 LEU CG -90.00 -30.00 -59.54 -88.27 -49.72 . . 0 "[ . 1 . 2]"
5 CHI1 1 23 GLU N 1 23 GLU CA 1 23 GLU CB 1 23 GLU CG -90.00 -30.00 -78.24 -72.25 -75.61 . . 0 "[ . 1 . 2]"
6 CHI1 1 25 PHE N 1 25 PHE CA 1 25 PHE CB 1 25 PHE CG -90.00 -30.00 -71.94 -83.03 -49.01 . . 0 "[ . 1 . 2]"
7 CHI1 1 28 ARG N 1 28 ARG CA 1 28 ARG CB 1 28 ARG CG -90.00 -30.00 -76.24 -89.26 -54.68 . . 0 "[ . 1 . 2]"
8 CHI1 1 31 LEU N 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG -90.00 -30.00 -53.90 -64.56 -44.27 . . 0 "[ . 1 . 2]"
9 CHI1 1 36 CYS N 1 36 CYS CA 1 36 CYS CB 1 36 CYS SG 30.00 90.00 55.34 57.45 56.41 . . 0 "[ . 1 . 2]"
10 CHI1 1 37 LYS N 1 37 LYS CA 1 37 LYS CB 1 37 LYS CG -90.00 -30.00 -71.55 -89.98 -58.27 . . 0 "[ . 1 . 2]"
11 CHI1 1 38 HIS N 1 38 HIS CA 1 38 HIS CB 1 38 HIS CG -90.00 -30.00 -80.61 -90.06 -73.20 0.06 16 0 "[ . 1 . 2]"
12 CHI1 1 40 PHE N 1 40 PHE CA 1 40 PHE CB 1 40 PHE CG -90.00 -30.00 -57.03 -65.16 -47.05 . . 0 "[ . 1 . 2]"
13 CHI1 1 41 HIS N 1 41 HIS CA 1 41 HIS CB 1 41 HIS CG -90.00 -30.00 -70.49 -71.41 -72.99 . . 0 "[ . 1 . 2]"
14 CHI1 1 42 ARG N 1 42 ARG CA 1 42 ARG CB 1 42 ARG CG -90.00 -30.00 -84.63 -76.53 -80.61 0.65 11 0 "[ . 1 . 2]"
15 CHI1 1 44 CYS N 1 44 CYS CA 1 44 CYS CB 1 44 CYS SG -90.00 -30.00 -71.70 -78.73 -66.87 . . 0 "[ . 1 . 2]"
16 CHI1 1 45 LEU N 1 45 LEU CA 1 45 LEU CB 1 45 LEU CG 150.00 -150.00 -159.67 -152.23 -154.87 . . 0 "[ . 1 . 2]"
17 CHI1 1 48 TRP N 1 48 TRP CA 1 48 TRP CB 1 48 TRP CG 150.00 -150.00 177.26 169.28 -175.45 . . 0 "[ . 1 . 2]"
18 CHI1 1 49 LEU N 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG -90.00 -30.00 -69.72 -72.98 -75.54 . . 0 "[ . 1 . 2]"
19 CHI1 1 50 GLU N 1 50 GLU CA 1 50 GLU CB 1 50 GLU CG -90.00 -30.00 -70.14 -82.65 -53.08 . . 0 "[ . 1 . 2]"
20 CHI1 1 55 CYS N 1 55 CYS CA 1 55 CYS CB 1 55 CYS SG 150.00 -150.00 -168.06 -166.03 -168.63 . . 0 "[ . 1 . 2]"
21 CHI1 1 57 LEU N 1 57 LEU CA 1 57 LEU CB 1 57 LEU CG -90.00 -30.00 -84.57 -87.96 -88.61 0.01 5 0 "[ . 1 . 2]"
22 CHI1 1 58 CYS N 1 58 CYS CA 1 58 CYS CB 1 58 CYS SG 30.00 90.00 56.06 54.76 52.63 . . 0 "[ . 1 . 2]"
23 PHI 1 16 GLU C 1 17 LEU N 1 17 LEU CA 1 17 LEU C -151.60 -91.50 -121.50 -125.41 -131.88 0.31 10 0 "[ . 1 . 2]"
24 PSI 1 17 LEU N 1 17 LEU CA 1 17 LEU C 1 18 CYS N 102.40 162.40 146.71 136.27 134.47 0.38 5 0 "[ . 1 . 2]"
25 PHI 1 19 ALA C 1 20 VAL N 1 20 VAL CA 1 20 VAL C -111.10 -51.10 -74.96 -111.30 -54.17 0.20 2 0 "[ . 1 . 2]"
26 PSI 1 20 VAL N 1 20 VAL CA 1 20 VAL C 1 21 CYS N -62.60 -2.60 -53.07 -46.41 -52.25 . . 0 "[ . 1 . 2]"
27 PSI 1 27 PRO N 1 27 PRO CA 1 27 PRO C 1 28 ARG N -60.20 -0.20 -36.61 -43.37 -26.65 . . 0 "[ . 1 . 2]"
28 PHI 1 27 PRO C 1 28 ARG N 1 28 ARG CA 1 28 ARG C -106.20 -46.20 -49.37 -47.30 -47.82 . . 0 "[ . 1 . 2]"
29 PSI 1 28 ARG N 1 28 ARG CA 1 28 ARG C 1 29 ASP N -42.80 17.20 -37.96 -40.15 -40.37 . . 0 "[ . 1 . 2]"
30 PHI 1 32 GLY C 1 33 ILE N 1 33 ILE CA 1 33 ILE C -144.20 -84.20 -87.21 -85.89 -87.59 0.41 2 0 "[ . 1 . 2]"
31 PSI 1 33 ILE N 1 33 ILE CA 1 33 ILE C 1 34 CYS N 99.40 159.40 123.59 138.84 136.58 0.33 6 0 "[ . 1 . 2]"
32 PHI 1 33 ILE C 1 34 CYS N 1 34 CYS CA 1 34 CYS C -107.30 -47.30 -83.95 -99.35 -101.39 . . 0 "[ . 1 . 2]"
33 PSI 1 34 CYS N 1 34 CYS CA 1 34 CYS C 1 35 PRO N 113.00 173.00 160.21 156.15 162.63 . . 0 "[ . 1 . 2]"
34 PSI 1 35 PRO N 1 35 PRO CA 1 35 PRO C 1 36 CYS N -53.50 6.50 3.73 5.06 4.48 . . 0 "[ . 1 . 2]"
35 PHI 1 36 CYS C 1 37 LYS N 1 37 LYS CA 1 37 LYS C 30.70 90.70 53.93 52.45 51.36 . . 0 "[ . 1 . 2]"
36 PSI 1 37 LYS N 1 37 LYS CA 1 37 LYS C 1 38 HIS N -5.90 54.10 41.61 43.53 42.87 . . 0 "[ . 1 . 2]"
37 PHI 1 38 HIS C 1 39 ALA N 1 39 ALA CA 1 39 ALA C -160.50 -100.50 -112.22 -138.88 -100.48 0.02 19 0 "[ . 1 . 2]"
38 PSI 1 39 ALA N 1 39 ALA CA 1 39 ALA C 1 40 PHE N 124.30 -175.70 144.58 146.76 144.43 . . 0 "[ . 1 . 2]"
39 PHI 1 39 ALA C 1 40 PHE N 1 40 PHE CA 1 40 PHE C -150.70 -90.70 -149.08 -150.99 -144.68 0.29 2 0 "[ . 1 . 2]"
40 PSI 1 40 PHE N 1 40 PHE CA 1 40 PHE C 1 41 HIS N 118.10 178.10 156.51 140.16 167.95 . . 0 "[ . 1 . 2]"
41 PHI 1 41 HIS C 1 42 ARG N 1 42 ARG CA 1 42 ARG C -96.60 -36.60 -39.43 -40.41 -42.79 0.50 11 0 "[ . 1 . 2]"
42 PSI 1 42 ARG N 1 42 ARG CA 1 42 ARG C 1 43 LYS N -73.30 -13.30 -38.51 -55.01 -20.55 . . 0 "[ . 1 . 2]"
43 PHI 1 42 ARG C 1 43 LYS N 1 43 LYS CA 1 43 LYS C -91.40 -31.40 -77.65 -71.72 -74.57 0.05 13 0 "[ . 1 . 2]"
44 PSI 1 43 LYS N 1 43 LYS CA 1 43 LYS C 1 44 CYS N -69.70 -9.70 -56.55 -67.46 -36.23 . . 0 "[ . 1 . 2]"
45 PHI 1 43 LYS C 1 44 CYS N 1 44 CYS CA 1 44 CYS C -93.50 -33.50 -46.19 -48.49 -50.74 . . 0 "[ . 1 . 2]"
46 PSI 1 44 CYS N 1 44 CYS CA 1 44 CYS C 1 45 LEU N -70.00 -10.00 -51.92 -62.38 -36.67 . . 0 "[ . 1 . 2]"
47 PHI 1 44 CYS C 1 45 LEU N 1 45 LEU CA 1 45 LEU C -95.30 -35.30 -55.51 -57.49 -59.71 . . 0 "[ . 1 . 2]"
48 PSI 1 45 LEU N 1 45 LEU CA 1 45 LEU C 1 46 ILE N -71.70 -11.70 -62.06 -65.31 -66.08 . . 0 "[ . 1 . 2]"
49 PHI 1 45 LEU C 1 46 ILE N 1 46 ILE CA 1 46 ILE C -94.70 -34.70 -44.08 -54.17 -36.71 . . 0 "[ . 1 . 2]"
50 PSI 1 46 ILE N 1 46 ILE CA 1 46 ILE C 1 47 LYS N -70.40 -10.40 -51.15 -43.27 -47.21 . . 0 "[ . 1 . 2]"
51 PHI 1 46 ILE C 1 47 LYS N 1 47 LYS CA 1 47 LYS C -93.20 -33.20 -60.13 -76.69 -49.99 . . 0 "[ . 1 . 2]"
52 PSI 1 47 LYS N 1 47 LYS CA 1 47 LYS C 1 48 TRP N -70.30 -10.30 -52.59 -58.79 -60.80 . . 0 "[ . 1 . 2]"
53 PHI 1 47 LYS C 1 48 TRP N 1 48 TRP CA 1 48 TRP C -94.10 -34.10 -55.54 -65.91 -46.29 . . 0 "[ . 1 . 2]"
54 PSI 1 48 TRP N 1 48 TRP CA 1 48 TRP C 1 49 LEU N -69.70 -9.70 -43.01 -64.13 -29.77 . . 0 "[ . 1 . 2]"
55 PHI 1 49 LEU C 1 50 GLU N 1 50 GLU CA 1 50 GLU C -96.30 -36.30 -51.67 -44.57 -46.73 . . 0 "[ . 1 . 2]"
56 PSI 1 50 GLU N 1 50 GLU CA 1 50 GLU C 1 51 VAL N -65.00 -5.00 -56.16 -65.28 -34.07 0.28 5 0 "[ . 1 . 2]"
57 PHI 1 53 LYS C 1 54 VAL N 1 54 VAL CA 1 54 VAL C -148.80 -88.80 -140.38 -141.37 -142.67 0.20 8 0 "[ . 1 . 2]"
58 PSI 1 54 VAL N 1 54 VAL CA 1 54 VAL C 1 55 CYS N 116.00 176.00 171.43 170.84 168.84 0.13 3 0 "[ . 1 . 2]"
59 PHI 1 54 VAL C 1 55 CYS N 1 55 CYS CA 1 55 CYS C -133.20 -73.20 -82.42 -93.24 -73.30 . . 0 "[ . 1 . 2]"
60 PSI 1 55 CYS N 1 55 CYS CA 1 55 CYS C 1 56 PRO N 112.80 172.80 126.99 128.29 127.78 . . 0 "[ . 1 . 2]"
61 PSI 1 61 PRO N 1 61 PRO CA 1 61 PRO C 1 62 VAL N 108.20 168.20 109.31 111.04 109.61 0.29 13 0 "[ . 1 . 2]"
stop_
save_
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