NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
486606 |
2kpa   |
16550 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2kpa
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 129
_TA_constraint_stats_list.Viol_count 499
_TA_constraint_stats_list.Viol_total 520018.91
_TA_constraint_stats_list.Viol_max 139.69
_TA_constraint_stats_list.Viol_rms 45.58
_TA_constraint_stats_list.Viol_average_all_restraints 27.99
_TA_constraint_stats_list.Viol_average_violations_only 86.84
_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 PSI 1 1 VAL N 1 1 VAL CA 1 1 VAL C 1 2 SER N -75.00 -175.00 -30.22 -36.84 -25.51 . . 0 "[ . 1 ]"
2 PSI 1 1 VAL N 1 1 VAL CA 1 1 VAL C 1 2 SER N 25.00 55.00 -30.22 -36.84 -25.51 61.84 4 12 [***+***-****]
3 PSI 1 1 VAL N 1 1 VAL CA 1 1 VAL C 1 2 SER N 105.00 -175.00 -30.22 -36.84 -25.51 139.69 10 12 [*******-*+**]
4 PHI 1 1 VAL C 1 2 SER N 1 2 SER CA 1 2 SER C -175.00 75.00 -80.25 -80.22 -80.24 . . 0 "[ . 1 ]"
5 PHI 1 1 VAL C 1 2 SER N 1 2 SER CA 1 2 SER C 105.00 -25.00 -80.25 -80.22 -80.24 . . 0 "[ . 1 ]"
6 PHI 1 1 VAL C 1 2 SER N 1 2 SER CA 1 2 SER C -135.00 75.00 -80.25 -80.22 -80.24 . . 0 "[ . 1 ]"
7 PSI 1 2 SER N 1 2 SER CA 1 2 SER C 1 3 VAL N -75.00 -175.00 -19.68 -19.66 -19.67 . . 0 "[ . 1 ]"
8 PSI 1 2 SER N 1 2 SER CA 1 2 SER C 1 3 VAL N 25.00 55.00 -19.68 -19.66 -19.67 44.81 11 12 [*********-+*]
9 PSI 1 2 SER N 1 2 SER CA 1 2 SER C 1 3 VAL N 105.00 -175.00 -19.68 -19.66 -19.67 124.81 11 12 [*********-+*]
10 PHI 1 2 SER C 1 3 VAL N 1 3 VAL CA 1 3 VAL C -175.00 75.00 -82.10 -82.13 -82.19 . . 0 "[ . 1 ]"
11 PHI 1 2 SER C 1 3 VAL N 1 3 VAL CA 1 3 VAL C 105.00 -25.00 -82.10 -82.13 -82.19 . . 0 "[ . 1 ]"
12 PHI 1 2 SER C 1 3 VAL N 1 3 VAL CA 1 3 VAL C -135.00 75.00 -82.10 -82.13 -82.19 . . 0 "[ . 1 ]"
13 PSI 1 3 VAL N 1 3 VAL CA 1 3 VAL C 1 4 ASP N -75.00 -175.00 -19.75 -19.43 -19.49 . . 0 "[ . 1 ]"
14 PSI 1 3 VAL N 1 3 VAL CA 1 3 VAL C 1 4 ASP N 25.00 55.00 -19.75 -19.43 -19.49 45.88 6 12 [**-**+******]
15 PSI 1 3 VAL N 1 3 VAL CA 1 3 VAL C 1 4 ASP N 105.00 -175.00 -19.75 -19.43 -19.49 125.88 6 12 [**-**+******]
16 PHI 1 5 PRO C 1 6 PHE N 1 6 PHE CA 1 6 PHE C -175.00 75.00 -107.38 -111.72 -104.59 . . 0 "[ . 1 ]"
17 PHI 1 5 PRO C 1 6 PHE N 1 6 PHE CA 1 6 PHE C 105.00 -25.00 -107.38 -111.72 -104.59 . . 0 "[ . 1 ]"
18 PHI 1 5 PRO C 1 6 PHE N 1 6 PHE CA 1 6 PHE C -135.00 75.00 -107.38 -111.72 -104.59 . . 0 "[ . 1 ]"
19 PSI 1 6 PHE N 1 6 PHE CA 1 6 PHE C 1 7 TYR N -75.00 -175.00 -7.47 -8.96 -9.13 . . 0 "[ . 1 ]"
20 PSI 1 6 PHE N 1 6 PHE CA 1 6 PHE C 1 7 TYR N 25.00 55.00 -7.47 -8.96 -9.13 34.22 1 12 [+****-******]
21 PSI 1 6 PHE N 1 6 PHE CA 1 6 PHE C 1 7 TYR N 105.00 -175.00 -7.47 -8.96 -9.13 114.22 1 12 [+****-******]
22 PHI 1 6 PHE C 1 7 TYR N 1 7 TYR CA 1 7 TYR C -175.00 75.00 -59.41 -59.94 -58.99 . . 0 "[ . 1 ]"
23 PHI 1 6 PHE C 1 7 TYR N 1 7 TYR CA 1 7 TYR C 105.00 -25.00 -59.41 -59.94 -58.99 . . 0 "[ . 1 ]"
24 PHI 1 6 PHE C 1 7 TYR N 1 7 TYR CA 1 7 TYR C -135.00 75.00 -59.41 -59.94 -58.99 . . 0 "[ . 1 ]"
25 PSI 1 7 TYR N 1 7 TYR CA 1 7 TYR C 1 8 GLU N -75.00 -175.00 -53.65 -54.86 -54.91 . . 0 "[ . 1 ]"
26 PSI 1 7 TYR N 1 7 TYR CA 1 7 TYR C 1 8 GLU N 25.00 55.00 -53.65 -54.86 -54.91 80.99 11 12 [*********-+*]
27 PSI 1 7 TYR N 1 7 TYR CA 1 7 TYR C 1 8 GLU N 105.00 -175.00 -53.65 -54.86 -54.91 125.93 10 12 [*********+-*]
28 PHI 1 7 TYR C 1 8 GLU N 1 8 GLU CA 1 8 GLU C -175.00 75.00 -62.00 -59.68 -59.79 . . 0 "[ . 1 ]"
29 PHI 1 7 TYR C 1 8 GLU N 1 8 GLU CA 1 8 GLU C 105.00 -25.00 -62.00 -59.68 -59.79 . . 0 "[ . 1 ]"
30 PHI 1 7 TYR C 1 8 GLU N 1 8 GLU CA 1 8 GLU C -135.00 75.00 -62.00 -59.68 -59.79 . . 0 "[ . 1 ]"
31 PSI 1 8 GLU N 1 8 GLU CA 1 8 GLU C 1 9 MET N -75.00 -175.00 -20.81 -21.08 -20.33 . . 0 "[ . 1 ]"
32 PSI 1 8 GLU N 1 8 GLU CA 1 8 GLU C 1 9 MET N 25.00 55.00 -20.81 -21.08 -20.33 46.08 12 12 [***-*******+]
33 PSI 1 8 GLU N 1 8 GLU CA 1 8 GLU C 1 9 MET N 105.00 -175.00 -20.81 -21.08 -20.33 126.08 12 12 [***-*******+]
34 PHI 1 8 GLU C 1 9 MET N 1 9 MET CA 1 9 MET C -175.00 75.00 -81.00 -81.33 -80.24 . . 0 "[ . 1 ]"
35 PHI 1 8 GLU C 1 9 MET N 1 9 MET CA 1 9 MET C 105.00 -25.00 -81.00 -81.33 -80.24 . . 0 "[ . 1 ]"
36 PHI 1 8 GLU C 1 9 MET N 1 9 MET CA 1 9 MET C -135.00 75.00 -81.00 -81.33 -80.24 . . 0 "[ . 1 ]"
37 PSI 1 9 MET N 1 9 MET CA 1 9 MET C 1 10 LEU N -75.00 -175.00 -58.92 -63.80 -49.99 . . 0 "[ . 1 ]"
38 PSI 1 9 MET N 1 9 MET CA 1 9 MET C 1 10 LEU N 25.00 55.00 -58.92 -63.80 -49.99 88.80 3 12 [**+*****-***]
39 PSI 1 9 MET N 1 9 MET CA 1 9 MET C 1 10 LEU N 105.00 -175.00 -58.92 -63.80 -49.99 125.01 9 12 [**-*****+***]
40 PHI 1 9 MET C 1 10 LEU N 1 10 LEU CA 1 10 LEU C -175.00 75.00 -66.08 -61.48 -61.82 . . 0 "[ . 1 ]"
41 PHI 1 9 MET C 1 10 LEU N 1 10 LEU CA 1 10 LEU C 105.00 -25.00 -66.08 -61.48 -61.82 . . 0 "[ . 1 ]"
42 PHI 1 9 MET C 1 10 LEU N 1 10 LEU CA 1 10 LEU C -135.00 75.00 -66.08 -61.48 -61.82 . . 0 "[ . 1 ]"
43 PSI 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 ALA N -75.00 -175.00 -42.84 -44.95 -39.18 . . 0 "[ . 1 ]"
44 PSI 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 ALA N 25.00 55.00 -42.84 -44.95 -39.18 69.95 8 12 [*******+-***]
45 PSI 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 ALA N 105.00 -175.00 -42.84 -44.95 -39.18 135.82 9 12 [*******-+***]
46 PHI 1 10 LEU C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -175.00 75.00 -70.29 -80.03 -61.61 . . 0 "[ . 1 ]"
47 PHI 1 10 LEU C 1 11 ALA N 1 11 ALA CA 1 11 ALA C 105.00 -25.00 -70.29 -80.03 -61.61 . . 0 "[ . 1 ]"
48 PHI 1 10 LEU C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -135.00 75.00 -70.29 -80.03 -61.61 . . 0 "[ . 1 ]"
49 PSI 1 11 ALA N 1 11 ALA CA 1 11 ALA C 1 12 ALA N -75.00 -175.00 -69.95 -73.07 -67.14 . . 0 "[ . 1 ]"
50 PSI 1 11 ALA N 1 11 ALA CA 1 11 ALA C 1 12 ALA N 25.00 55.00 -69.95 -73.07 -67.14 98.07 7 12 [******+**-**]
51 PSI 1 11 ALA N 1 11 ALA CA 1 11 ALA C 1 12 ALA N 105.00 -175.00 -69.95 -73.07 -67.14 107.86 10 12 [******-**+**]
52 PHI 1 11 ALA C 1 12 ALA N 1 12 ALA CA 1 12 ALA C -175.00 75.00 -69.20 -76.14 -59.94 . . 0 "[ . 1 ]"
53 PHI 1 11 ALA C 1 12 ALA N 1 12 ALA CA 1 12 ALA C 105.00 -25.00 -69.20 -76.14 -59.94 . . 0 "[ . 1 ]"
54 PHI 1 11 ALA C 1 12 ALA N 1 12 ALA CA 1 12 ALA C -135.00 75.00 -69.20 -76.14 -59.94 . . 0 "[ . 1 ]"
55 PSI 1 12 ALA N 1 12 ALA CA 1 12 ALA C 1 13 ARG N -75.00 -175.00 126.09 103.84 139.87 . . 0 "[ . 1 ]"
56 PSI 1 12 ALA N 1 12 ALA CA 1 12 ALA C 1 13 ARG N 25.00 55.00 126.09 103.84 139.87 84.87 6 12 [*****+***-**]
57 PSI 1 12 ALA N 1 12 ALA CA 1 12 ALA C 1 13 ARG N 105.00 -175.00 126.09 103.84 139.87 1.16 10 0 "[ . 1 ]"
58 PHI 1 12 ALA C 1 13 ARG N 1 13 ARG CA 1 13 ARG C -175.00 75.00 -80.20 -81.46 -75.99 . . 0 "[ . 1 ]"
59 PHI 1 12 ALA C 1 13 ARG N 1 13 ARG CA 1 13 ARG C 105.00 -25.00 -80.20 -81.46 -75.99 . . 0 "[ . 1 ]"
60 PHI 1 12 ALA C 1 13 ARG N 1 13 ARG CA 1 13 ARG C -135.00 75.00 -80.20 -81.46 -75.99 . . 0 "[ . 1 ]"
61 PSI 1 13 ARG N 1 13 ARG CA 1 13 ARG C 1 14 LYS N -75.00 -175.00 -0.16 -0.21 -1.89 . . 0 "[ . 1 ]"
62 PSI 1 13 ARG N 1 13 ARG CA 1 13 ARG C 1 14 LYS N 25.00 55.00 -0.16 -0.21 -1.89 30.60 5 12 [***-+*******]
63 PSI 1 13 ARG N 1 13 ARG CA 1 13 ARG C 1 14 LYS N 105.00 -175.00 -0.16 -0.21 -1.89 110.60 5 12 [***-+*******]
64 PHI 1 13 ARG C 1 14 LYS N 1 14 LYS CA 1 14 LYS C -175.00 75.00 -68.10 -82.52 -59.87 . . 0 "[ . 1 ]"
65 PHI 1 13 ARG C 1 14 LYS N 1 14 LYS CA 1 14 LYS C 105.00 -25.00 -68.10 -82.52 -59.87 . . 0 "[ . 1 ]"
66 PHI 1 13 ARG C 1 14 LYS N 1 14 LYS CA 1 14 LYS C -135.00 75.00 -68.10 -82.52 -59.87 . . 0 "[ . 1 ]"
67 PSI 1 14 LYS N 1 14 LYS CA 1 14 LYS C 1 15 LYS N -75.00 -175.00 -12.92 -17.37 -17.96 . . 0 "[ . 1 ]"
68 PSI 1 14 LYS N 1 14 LYS CA 1 14 LYS C 1 15 LYS N 25.00 55.00 -12.92 -17.37 -17.96 45.16 7 12 [****-*+*****]
69 PSI 1 14 LYS N 1 14 LYS CA 1 14 LYS C 1 15 LYS N 105.00 -175.00 -12.92 -17.37 -17.96 125.16 7 12 [****-*+*****]
70 PHI 1 14 LYS C 1 15 LYS N 1 15 LYS CA 1 15 LYS C -175.00 75.00 -62.36 -74.14 -59.59 . . 0 "[ . 1 ]"
71 PHI 1 14 LYS C 1 15 LYS N 1 15 LYS CA 1 15 LYS C 105.00 -25.00 -62.36 -74.14 -59.59 . . 0 "[ . 1 ]"
72 PHI 1 14 LYS C 1 15 LYS N 1 15 LYS CA 1 15 LYS C -135.00 75.00 -62.36 -74.14 -59.59 . . 0 "[ . 1 ]"
73 PSI 1 15 LYS N 1 15 LYS CA 1 15 LYS C 1 16 ARG N -75.00 -175.00 -59.65 -64.01 -54.44 . . 0 "[ . 1 ]"
74 PSI 1 15 LYS N 1 15 LYS CA 1 15 LYS C 1 16 ARG N 25.00 55.00 -59.65 -64.01 -54.44 89.01 2 12 [*+*-********]
75 PSI 1 15 LYS N 1 15 LYS CA 1 15 LYS C 1 16 ARG N 105.00 -175.00 -59.65 -64.01 -54.44 120.56 4 12 [*-*+********]
76 PHI 1 15 LYS C 1 16 ARG N 1 16 ARG CA 1 16 ARG C -175.00 75.00 -62.54 -80.17 -59.58 . . 0 "[ . 1 ]"
77 PHI 1 15 LYS C 1 16 ARG N 1 16 ARG CA 1 16 ARG C 105.00 -25.00 -62.54 -80.17 -59.58 . . 0 "[ . 1 ]"
78 PHI 1 15 LYS C 1 16 ARG N 1 16 ARG CA 1 16 ARG C -135.00 75.00 -62.54 -80.17 -59.58 . . 0 "[ . 1 ]"
79 PSI 1 16 ARG N 1 16 ARG CA 1 16 ARG C 1 17 ILE N -75.00 -175.00 -20.70 -19.71 -20.09 . . 0 "[ . 1 ]"
80 PSI 1 16 ARG N 1 16 ARG CA 1 16 ARG C 1 17 ILE N 25.00 55.00 -20.70 -19.71 -20.09 61.61 8 12 [****-**+****]
81 PSI 1 16 ARG N 1 16 ARG CA 1 16 ARG C 1 17 ILE N 105.00 -175.00 -20.70 -19.71 -20.09 138.39 8 12 [****-**+****]
82 PHI 1 16 ARG C 1 17 ILE N 1 17 ILE CA 1 17 ILE C -175.00 75.00 -79.88 -80.76 -80.83 . . 0 "[ . 1 ]"
83 PHI 1 16 ARG C 1 17 ILE N 1 17 ILE CA 1 17 ILE C 105.00 -25.00 -79.88 -80.76 -80.83 . . 0 "[ . 1 ]"
84 PHI 1 16 ARG C 1 17 ILE N 1 17 ILE CA 1 17 ILE C -135.00 75.00 -79.88 -80.76 -80.83 . . 0 "[ . 1 ]"
85 PSI 1 17 ILE N 1 17 ILE CA 1 17 ILE C 1 18 SER N -75.00 -175.00 -42.45 -39.49 -39.52 . . 0 "[ . 1 ]"
86 PSI 1 17 ILE N 1 17 ILE CA 1 17 ILE C 1 18 SER N 25.00 55.00 -42.45 -39.49 -39.52 78.76 6 12 [****-+******]
87 PSI 1 17 ILE N 1 17 ILE CA 1 17 ILE C 1 18 SER N 105.00 -175.00 -42.45 -39.49 -39.52 135.61 5 12 [****+-******]
88 PHI 1 17 ILE C 1 18 SER N 1 18 SER CA 1 18 SER C -175.00 75.00 -80.88 -81.92 -80.36 . . 0 "[ . 1 ]"
89 PHI 1 17 ILE C 1 18 SER N 1 18 SER CA 1 18 SER C 105.00 -25.00 -80.88 -81.92 -80.36 . . 0 "[ . 1 ]"
90 PHI 1 17 ILE C 1 18 SER N 1 18 SER CA 1 18 SER C -135.00 75.00 -80.88 -81.92 -80.36 . . 0 "[ . 1 ]"
91 PSI 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 VAL N -75.00 -175.00 -2.04 1.69 1.52 . . 0 "[ . 1 ]"
92 PSI 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 VAL N 25.00 55.00 -2.04 1.69 1.52 45.38 10 12 [*******-*+**]
93 PSI 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 VAL N 105.00 -175.00 -2.04 1.69 1.52 125.38 10 12 [*******-*+**]
94 PHI 1 18 SER C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -175.00 75.00 -59.35 -59.16 -59.24 . . 0 "[ . 1 ]"
95 PHI 1 18 SER C 1 19 VAL N 1 19 VAL CA 1 19 VAL C 105.00 -25.00 -59.35 -59.16 -59.24 . . 0 "[ . 1 ]"
96 PHI 1 18 SER C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -135.00 75.00 -59.35 -59.16 -59.24 . . 0 "[ . 1 ]"
97 PSI 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 LYS N -75.00 -175.00 146.14 140.35 155.10 . . 0 "[ . 1 ]"
98 PSI 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 LYS N 25.00 55.00 146.14 140.35 155.10 100.10 7 12 [*-****+*****]
99 PSI 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 LYS N 105.00 -175.00 146.14 140.35 155.10 . . 0 "[ . 1 ]"
100 PHI 1 19 VAL C 1 20 LYS N 1 20 LYS CA 1 20 LYS C -175.00 75.00 -75.20 -81.64 -63.39 . . 0 "[ . 1 ]"
101 PHI 1 19 VAL C 1 20 LYS N 1 20 LYS CA 1 20 LYS C 105.00 -25.00 -75.20 -81.64 -63.39 . . 0 "[ . 1 ]"
102 PHI 1 19 VAL C 1 20 LYS N 1 20 LYS CA 1 20 LYS C -135.00 75.00 -75.20 -81.64 -63.39 . . 0 "[ . 1 ]"
103 PSI 1 20 LYS N 1 20 LYS CA 1 20 LYS C 1 21 LYS N -75.00 -175.00 -14.13 -15.28 -18.21 . . 0 "[ . 1 ]"
104 PSI 1 20 LYS N 1 20 LYS CA 1 20 LYS C 1 21 LYS N 25.00 55.00 -14.13 -15.28 -18.21 45.08 1 12 [+**********-]
105 PSI 1 20 LYS N 1 20 LYS CA 1 20 LYS C 1 21 LYS N 105.00 -175.00 -14.13 -15.28 -18.21 125.08 1 12 [+**********-]
106 PHI 1 20 LYS C 1 21 LYS N 1 21 LYS CA 1 21 LYS C -175.00 75.00 -62.02 -60.02 -60.46 . . 0 "[ . 1 ]"
107 PHI 1 20 LYS C 1 21 LYS N 1 21 LYS CA 1 21 LYS C 105.00 -25.00 -62.02 -60.02 -60.46 . . 0 "[ . 1 ]"
108 PHI 1 20 LYS C 1 21 LYS N 1 21 LYS CA 1 21 LYS C -135.00 75.00 -62.02 -60.02 -60.46 . . 0 "[ . 1 ]"
109 PSI 1 21 LYS N 1 21 LYS CA 1 21 LYS C 1 22 LYS N -75.00 -175.00 -45.42 -66.24 -39.84 . . 0 "[ . 1 ]"
110 PSI 1 21 LYS N 1 21 LYS CA 1 21 LYS C 1 22 LYS N 25.00 55.00 -45.42 -66.24 -39.84 91.24 12 12 [***-*******+]
111 PSI 1 21 LYS N 1 21 LYS CA 1 21 LYS C 1 22 LYS N 105.00 -175.00 -45.42 -66.24 -39.84 135.16 4 12 [***+*******-]
112 PHI 1 21 LYS C 1 22 LYS N 1 22 LYS CA 1 22 LYS C -175.00 75.00 -66.06 -63.92 -72.87 . . 0 "[ . 1 ]"
113 PHI 1 21 LYS C 1 22 LYS N 1 22 LYS CA 1 22 LYS C 105.00 -25.00 -66.06 -63.92 -72.87 . . 0 "[ . 1 ]"
114 PHI 1 21 LYS C 1 22 LYS N 1 22 LYS CA 1 22 LYS C -135.00 75.00 -66.06 -63.92 -72.87 . . 0 "[ . 1 ]"
115 PSI 1 22 LYS N 1 22 LYS CA 1 22 LYS C 1 23 GLN N -75.00 -175.00 -19.92 -39.54 1.96 . . 0 "[ . 1 ]"
116 PSI 1 22 LYS N 1 22 LYS CA 1 22 LYS C 1 23 GLN N 25.00 55.00 -19.92 -39.54 1.96 64.54 8 12 [*******+***-]
117 PSI 1 22 LYS N 1 22 LYS CA 1 22 LYS C 1 23 GLN N 105.00 -175.00 -19.92 -39.54 1.96 135.46 8 12 [*******+***-]
118 PHI 1 22 LYS C 1 23 GLN N 1 23 GLN CA 1 23 GLN C -175.00 75.00 -73.78 -76.25 -76.92 . . 0 "[ . 1 ]"
119 PHI 1 22 LYS C 1 23 GLN N 1 23 GLN CA 1 23 GLN C 105.00 -25.00 -73.78 -76.25 -76.92 . . 0 "[ . 1 ]"
120 PHI 1 22 LYS C 1 23 GLN N 1 23 GLN CA 1 23 GLN C -135.00 75.00 -73.78 -76.25 -76.92 . . 0 "[ . 1 ]"
121 PSI 1 23 GLN N 1 23 GLN CA 1 23 GLN C 1 24 GLU N -75.00 -175.00 -26.11 67.66 -20.06 . . 0 "[ . 1 ]"
122 PSI 1 23 GLN N 1 23 GLN CA 1 23 GLN C 1 24 GLU N 25.00 55.00 -26.11 67.66 -20.06 88.93 11 12 [******-***+*]
123 PSI 1 23 GLN N 1 23 GLN CA 1 23 GLN C 1 24 GLU N 105.00 -175.00 -26.11 67.66 -20.06 137.43 12 12 [*-*********+]
124 PHI 1 23 GLN C 1 24 GLU N 1 24 GLU CA 1 24 GLU C -175.00 75.00 -70.74 -80.39 -60.57 . . 0 "[ . 1 ]"
125 PHI 1 23 GLN C 1 24 GLU N 1 24 GLU CA 1 24 GLU C 105.00 -25.00 -70.74 -80.39 -60.57 . . 0 "[ . 1 ]"
126 PHI 1 23 GLN C 1 24 GLU N 1 24 GLU CA 1 24 GLU C -135.00 75.00 -70.74 -80.39 -60.57 . . 0 "[ . 1 ]"
127 PSI 1 24 GLU N 1 24 GLU CA 1 24 GLU C 1 25 GLN N -75.00 -175.00 65.10 -39.23 171.43 . . 0 "[ . 1 ]"
128 PSI 1 24 GLU N 1 24 GLU CA 1 24 GLU C 1 25 GLN N 25.00 55.00 65.10 -39.23 171.43 116.43 1 12 [+*-*********]
129 PSI 1 24 GLU N 1 24 GLU CA 1 24 GLU C 1 25 GLN N 105.00 -175.00 65.10 -39.23 171.43 135.77 10 6 "[ *- . * *+ *]"
stop_
save_
save_dihedral_constraint_statistics_2
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 144
_TA_constraint_stats_list.Viol_count 136
_TA_constraint_stats_list.Viol_total 16145.76
_TA_constraint_stats_list.Viol_max 29.42
_TA_constraint_stats_list.Viol_rms 3.56
_TA_constraint_stats_list.Viol_average_all_restraints 0.78
_TA_constraint_stats_list.Viol_average_violations_only 9.89
_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 1 VAL N 1 1 VAL CA 1 1 VAL CB 1 1 VAL CG1 -90.00 -150.00 -173.94 179.77 66.45 . . 0 "[ . 1 ]"
2 CHI1 1 1 VAL N 1 1 VAL CA 1 1 VAL CB 1 1 VAL CG1 30.00 -30.00 -173.94 179.77 66.45 . . 0 "[ . 1 ]"
3 CHI1 1 1 VAL N 1 1 VAL CA 1 1 VAL CB 1 1 VAL CG1 150.00 90.00 -173.94 179.77 66.45 . . 0 "[ . 1 ]"
4 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG -90.00 -150.00 -173.79 -153.55 -164.46 1.95 2 0 "[ . 1 ]"
5 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG 30.00 -30.00 -173.79 -153.55 -164.46 . . 0 "[ . 1 ]"
6 CHI1 1 2 SER N 1 2 SER CA 1 2 SER CB 1 2 SER OG 150.00 90.00 -173.79 -153.55 -164.46 3.10 9 0 "[ . 1 ]"
7 CHI1 1 3 VAL N 1 3 VAL CA 1 3 VAL CB 1 3 VAL CG1 -90.00 -150.00 -145.47 -177.12 -68.31 . . 0 "[ . 1 ]"
8 CHI1 1 3 VAL N 1 3 VAL CA 1 3 VAL CB 1 3 VAL CG1 30.00 -30.00 -145.47 -177.12 -68.31 . . 0 "[ . 1 ]"
9 CHI1 1 3 VAL N 1 3 VAL CA 1 3 VAL CB 1 3 VAL CG1 150.00 90.00 -145.47 -177.12 -68.31 . . 0 "[ . 1 ]"
10 CHI1 1 4 ASP N 1 4 ASP CA 1 4 ASP CB 1 4 ASP CG -90.00 -150.00 -173.65 153.26 153.18 29.09 6 5 "[ -*.+* 1 *]"
11 CHI1 1 4 ASP N 1 4 ASP CA 1 4 ASP CB 1 4 ASP CG 30.00 -30.00 -173.65 153.26 153.18 . . 0 "[ . 1 ]"
12 CHI1 1 4 ASP N 1 4 ASP CA 1 4 ASP CB 1 4 ASP CG 150.00 90.00 -173.65 153.26 153.18 . . 0 "[ . 1 ]"
13 CHI1 1 6 PHE N 1 6 PHE CA 1 6 PHE CB 1 6 PHE CG -90.00 -150.00 -98.13 -99.18 -99.28 9.68 3 12 [**+*****-***]
14 CHI1 1 6 PHE N 1 6 PHE CA 1 6 PHE CB 1 6 PHE CG 30.00 -30.00 -98.13 -99.18 -99.28 . . 0 "[ . 1 ]"
15 CHI1 1 6 PHE N 1 6 PHE CA 1 6 PHE CB 1 6 PHE CG 150.00 90.00 -98.13 -99.18 -99.28 . . 0 "[ . 1 ]"
16 CHI1 1 7 TYR N 1 7 TYR CA 1 7 TYR CB 1 7 TYR CG -90.00 -150.00 -98.70 -103.12 -95.02 13.12 9 12 [********+**-]
17 CHI1 1 7 TYR N 1 7 TYR CA 1 7 TYR CB 1 7 TYR CG 30.00 -30.00 -98.70 -103.12 -95.02 . . 0 "[ . 1 ]"
18 CHI1 1 7 TYR N 1 7 TYR CA 1 7 TYR CB 1 7 TYR CG 150.00 90.00 -98.70 -103.12 -95.02 . . 0 "[ . 1 ]"
19 CHI1 1 8 GLU N 1 8 GLU CA 1 8 GLU CB 1 8 GLU CG -90.00 -150.00 38.12 71.05 70.11 . . 0 "[ . 1 ]"
20 CHI1 1 8 GLU N 1 8 GLU CA 1 8 GLU CB 1 8 GLU CG 30.00 -30.00 38.12 71.05 70.11 . . 0 "[ . 1 ]"
21 CHI1 1 8 GLU N 1 8 GLU CA 1 8 GLU CB 1 8 GLU CG 150.00 90.00 38.12 71.05 70.11 . . 0 "[ . 1 ]"
22 CHI2 1 8 GLU CA 1 8 GLU CB 1 8 GLU CG 1 8 GLU CD -90.00 -150.00 -158.31 -148.38 -149.46 25.62 7 1 "[ . + 1 ]"
23 CHI2 1 8 GLU CA 1 8 GLU CB 1 8 GLU CG 1 8 GLU CD 30.00 -30.00 -158.31 -148.38 -149.46 . . 0 "[ . 1 ]"
24 CHI2 1 8 GLU CA 1 8 GLU CB 1 8 GLU CG 1 8 GLU CD 150.00 90.00 -158.31 -148.38 -149.46 8.18 12 1 "[ . 1 +]"
25 CHI1 1 9 MET N 1 9 MET CA 1 9 MET CB 1 9 MET CG -90.00 -150.00 -40.27 -41.83 -39.31 . . 0 "[ . 1 ]"
26 CHI1 1 9 MET N 1 9 MET CA 1 9 MET CB 1 9 MET CG 30.00 -30.00 -40.27 -41.83 -39.31 . . 0 "[ . 1 ]"
27 CHI1 1 9 MET N 1 9 MET CA 1 9 MET CB 1 9 MET CG 150.00 90.00 -40.27 -41.83 -39.31 . . 0 "[ . 1 ]"
28 CHI2 1 9 MET CA 1 9 MET CB 1 9 MET CG 1 9 MET SD -90.00 -150.00 -61.70 -64.38 -58.59 . . 0 "[ . 1 ]"
29 CHI2 1 9 MET CA 1 9 MET CB 1 9 MET CG 1 9 MET SD 30.00 -30.00 -61.70 -64.38 -58.59 . . 0 "[ . 1 ]"
30 CHI2 1 9 MET CA 1 9 MET CB 1 9 MET CG 1 9 MET SD 150.00 90.00 -61.70 -64.38 -58.59 . . 0 "[ . 1 ]"
31 CHI1 1 10 LEU N 1 10 LEU CA 1 10 LEU CB 1 10 LEU CG -90.00 -150.00 -49.29 -49.09 -49.16 . . 0 "[ . 1 ]"
32 CHI1 1 10 LEU N 1 10 LEU CA 1 10 LEU CB 1 10 LEU CG 30.00 -30.00 -49.29 -49.09 -49.16 . . 0 "[ . 1 ]"
33 CHI1 1 10 LEU N 1 10 LEU CA 1 10 LEU CB 1 10 LEU CG 150.00 90.00 -49.29 -49.09 -49.16 . . 0 "[ . 1 ]"
34 CHI2 1 10 LEU CA 1 10 LEU CB 1 10 LEU CG 1 10 LEU CD1 -90.00 -150.00 147.26 143.30 148.35 . . 0 "[ . 1 ]"
35 CHI2 1 10 LEU CA 1 10 LEU CB 1 10 LEU CG 1 10 LEU CD1 30.00 -30.00 147.26 143.30 148.35 . . 0 "[ . 1 ]"
36 CHI2 1 10 LEU CA 1 10 LEU CB 1 10 LEU CG 1 10 LEU CD1 150.00 90.00 147.26 143.30 148.35 6.70 9 1 "[ . +1 ]"
37 CHI1 1 13 ARG N 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG -90.00 -150.00 -50.21 -103.96 98.44 13.96 2 2 "[ + . -1 ]"
38 CHI1 1 13 ARG N 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG 30.00 -30.00 -50.21 -103.96 98.44 . . 0 "[ . 1 ]"
39 CHI1 1 13 ARG N 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG 150.00 90.00 -50.21 -103.96 98.44 8.44 10 2 "[- . + ]"
40 CHI2 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG 1 13 ARG CD -90.00 -150.00 -82.19 69.18 -55.85 . . 0 "[ . 1 ]"
41 CHI2 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG 1 13 ARG CD 30.00 -30.00 -82.19 69.18 -55.85 . . 0 "[ . 1 ]"
42 CHI2 1 13 ARG CA 1 13 ARG CB 1 13 ARG CG 1 13 ARG CD 150.00 90.00 -82.19 69.18 -55.85 21.55 11 2 "[ . 1+-]"
43 CHI3 1 13 ARG CB 1 13 ARG CG 1 13 ARG CD 1 13 ARG NE -90.00 -150.00 -148.04 133.24 -109.07 26.93 4 7 "[* *+.- * ** ]"
44 CHI3 1 13 ARG CB 1 13 ARG CG 1 13 ARG CD 1 13 ARG NE 30.00 -30.00 -148.04 133.24 -109.07 . . 0 "[ . 1 ]"
45 CHI3 1 13 ARG CB 1 13 ARG CG 1 13 ARG CD 1 13 ARG NE 150.00 90.00 -148.04 133.24 -109.07 16.76 7 2 "[ - + 1 ]"
46 CHI1 1 14 LYS N 1 14 LYS CA 1 14 LYS CB 1 14 LYS CG -90.00 -150.00 -47.32 56.59 -45.48 0.99 12 0 "[ . 1 ]"
47 CHI1 1 14 LYS N 1 14 LYS CA 1 14 LYS CB 1 14 LYS CG 30.00 -30.00 -47.32 56.59 -45.48 . . 0 "[ . 1 ]"
48 CHI1 1 14 LYS N 1 14 LYS CA 1 14 LYS CB 1 14 LYS CG 150.00 90.00 -47.32 56.59 -45.48 . . 0 "[ . 1 ]"
49 CHI2 1 14 LYS CA 1 14 LYS CB 1 14 LYS CG 1 14 LYS CD -90.00 -150.00 160.79 83.91 -68.13 25.73 10 1 "[ . + ]"
50 CHI2 1 14 LYS CA 1 14 LYS CB 1 14 LYS CG 1 14 LYS CD 30.00 -30.00 160.79 83.91 -68.13 . . 0 "[ . 1 ]"
51 CHI2 1 14 LYS CA 1 14 LYS CB 1 14 LYS CG 1 14 LYS CD 150.00 90.00 160.79 83.91 -68.13 1.85 2 0 "[ . 1 ]"
52 CHI3 1 14 LYS CB 1 14 LYS CG 1 14 LYS CD 1 14 LYS CE -90.00 -150.00 -123.62 81.37 -75.65 4.10 2 0 "[ . 1 ]"
53 CHI3 1 14 LYS CB 1 14 LYS CG 1 14 LYS CD 1 14 LYS CE 30.00 -30.00 -123.62 81.37 -75.65 . . 0 "[ . 1 ]"
54 CHI3 1 14 LYS CB 1 14 LYS CG 1 14 LYS CD 1 14 LYS CE 150.00 90.00 -123.62 81.37 -75.65 4.33 6 0 "[ . 1 ]"
55 CHI4 1 14 LYS CG 1 14 LYS CD 1 14 LYS CE 1 14 LYS NZ -90.00 -150.00 177.04 -139.94 -149.60 10.06 2 1 "[ + . 1 ]"
56 CHI4 1 14 LYS CG 1 14 LYS CD 1 14 LYS CE 1 14 LYS NZ 30.00 -30.00 177.04 -139.94 -149.60 . . 0 "[ . 1 ]"
57 CHI4 1 14 LYS CG 1 14 LYS CD 1 14 LYS CE 1 14 LYS NZ 150.00 90.00 177.04 -139.94 -149.60 0.26 10 0 "[ . 1 ]"
58 CHI1 1 15 LYS N 1 15 LYS CA 1 15 LYS CB 1 15 LYS CG -90.00 -150.00 -165.03 172.47 -118.02 28.02 11 1 "[ . 1+ ]"
59 CHI1 1 15 LYS N 1 15 LYS CA 1 15 LYS CB 1 15 LYS CG 30.00 -30.00 -165.03 172.47 -118.02 . . 0 "[ . 1 ]"
60 CHI1 1 15 LYS N 1 15 LYS CA 1 15 LYS CB 1 15 LYS CG 150.00 90.00 -165.03 172.47 -118.02 . . 0 "[ . 1 ]"
61 CHI2 1 15 LYS CA 1 15 LYS CB 1 15 LYS CG 1 15 LYS CD -90.00 -150.00 -117.71 122.95 -65.96 27.73 4 3 "[ * +. - 1 ]"
62 CHI2 1 15 LYS CA 1 15 LYS CB 1 15 LYS CG 1 15 LYS CD 30.00 -30.00 -117.71 122.95 -65.96 . . 0 "[ . 1 ]"
63 CHI2 1 15 LYS CA 1 15 LYS CB 1 15 LYS CG 1 15 LYS CD 150.00 90.00 -117.71 122.95 -65.96 27.05 10 1 "[ . + ]"
64 CHI3 1 15 LYS CB 1 15 LYS CG 1 15 LYS CD 1 15 LYS CE -90.00 -150.00 -121.65 -87.29 -93.37 4.29 11 0 "[ . 1 ]"
65 CHI3 1 15 LYS CB 1 15 LYS CG 1 15 LYS CD 1 15 LYS CE 30.00 -30.00 -121.65 -87.29 -93.37 . . 0 "[ . 1 ]"
66 CHI3 1 15 LYS CB 1 15 LYS CG 1 15 LYS CD 1 15 LYS CE 150.00 90.00 -121.65 -87.29 -93.37 17.12 5 3 "[ + - *1 ]"
67 CHI4 1 15 LYS CG 1 15 LYS CD 1 15 LYS CE 1 15 LYS NZ -90.00 -150.00 177.38 78.22 -61.42 18.53 11 1 "[ . 1+ ]"
68 CHI4 1 15 LYS CG 1 15 LYS CD 1 15 LYS CE 1 15 LYS NZ 30.00 -30.00 177.38 78.22 -61.42 . . 0 "[ . 1 ]"
69 CHI4 1 15 LYS CG 1 15 LYS CD 1 15 LYS CE 1 15 LYS NZ 150.00 90.00 177.38 78.22 -61.42 16.98 4 1 "[ +. 1 ]"
70 CHI1 1 16 ARG N 1 16 ARG CA 1 16 ARG CB 1 16 ARG CG -90.00 -150.00 66.51 46.14 74.95 . . 0 "[ . 1 ]"
71 CHI1 1 16 ARG N 1 16 ARG CA 1 16 ARG CB 1 16 ARG CG 30.00 -30.00 66.51 46.14 74.95 . . 0 "[ . 1 ]"
72 CHI1 1 16 ARG N 1 16 ARG CA 1 16 ARG CB 1 16 ARG CG 150.00 90.00 66.51 46.14 74.95 . . 0 "[ . 1 ]"
73 CHI2 1 16 ARG CA 1 16 ARG CB 1 16 ARG CG 1 16 ARG CD -90.00 -150.00 -149.33 173.76 -106.91 16.91 8 6 "[ *-.**+ 1 *]"
74 CHI2 1 16 ARG CA 1 16 ARG CB 1 16 ARG CG 1 16 ARG CD 30.00 -30.00 -149.33 173.76 -106.91 . . 0 "[ . 1 ]"
75 CHI2 1 16 ARG CA 1 16 ARG CB 1 16 ARG CG 1 16 ARG CD 150.00 90.00 -149.33 173.76 -106.91 . . 0 "[ . 1 ]"
76 CHI3 1 16 ARG CB 1 16 ARG CG 1 16 ARG CD 1 16 ARG NE -90.00 -150.00 -136.93 153.06 48.97 20.70 7 7 "[*-**.*+ 1 *]"
77 CHI3 1 16 ARG CB 1 16 ARG CG 1 16 ARG CD 1 16 ARG NE 30.00 -30.00 -136.93 153.06 48.97 . . 0 "[ . 1 ]"
78 CHI3 1 16 ARG CB 1 16 ARG CG 1 16 ARG CD 1 16 ARG NE 150.00 90.00 -136.93 153.06 48.97 . . 0 "[ . 1 ]"
79 CHI1 1 17 ILE N 1 17 ILE CA 1 17 ILE CB 1 17 ILE CG1 -90.00 -150.00 -53.74 -58.74 -58.80 . . 0 "[ . 1 ]"
80 CHI1 1 17 ILE N 1 17 ILE CA 1 17 ILE CB 1 17 ILE CG1 30.00 -30.00 -53.74 -58.74 -58.80 . . 0 "[ . 1 ]"
81 CHI1 1 17 ILE N 1 17 ILE CA 1 17 ILE CB 1 17 ILE CG1 150.00 90.00 -53.74 -58.74 -58.80 . . 0 "[ . 1 ]"
82 CHI21 1 17 ILE CA 1 17 ILE CB 1 17 ILE CG1 1 17 ILE CD1 -90.00 -150.00 -125.20 161.66 -53.98 . . 0 "[ . 1 ]"
83 CHI21 1 17 ILE CA 1 17 ILE CB 1 17 ILE CG1 1 17 ILE CD1 30.00 -30.00 -125.20 161.66 -53.98 . . 0 "[ . 1 ]"
84 CHI21 1 17 ILE CA 1 17 ILE CB 1 17 ILE CG1 1 17 ILE CD1 150.00 90.00 -125.20 161.66 -53.98 . . 0 "[ . 1 ]"
85 CHI1 1 18 SER N 1 18 SER CA 1 18 SER CB 1 18 SER OG -90.00 -150.00 -119.43 71.77 -35.49 . . 0 "[ . 1 ]"
86 CHI1 1 18 SER N 1 18 SER CA 1 18 SER CB 1 18 SER OG 30.00 -30.00 -119.43 71.77 -35.49 . . 0 "[ . 1 ]"
87 CHI1 1 18 SER N 1 18 SER CA 1 18 SER CB 1 18 SER OG 150.00 90.00 -119.43 71.77 -35.49 . . 0 "[ . 1 ]"
88 CHI1 1 19 VAL N 1 19 VAL CA 1 19 VAL CB 1 19 VAL CG1 -90.00 -150.00 75.77 73.14 79.57 . . 0 "[ . 1 ]"
89 CHI1 1 19 VAL N 1 19 VAL CA 1 19 VAL CB 1 19 VAL CG1 30.00 -30.00 75.77 73.14 79.57 . . 0 "[ . 1 ]"
90 CHI1 1 19 VAL N 1 19 VAL CA 1 19 VAL CB 1 19 VAL CG1 150.00 90.00 75.77 73.14 79.57 . . 0 "[ . 1 ]"
91 CHI1 1 20 LYS N 1 20 LYS CA 1 20 LYS CB 1 20 LYS CG -90.00 -150.00 -52.14 -53.03 -55.94 . . 0 "[ . 1 ]"
92 CHI1 1 20 LYS N 1 20 LYS CA 1 20 LYS CB 1 20 LYS CG 30.00 -30.00 -52.14 -53.03 -55.94 . . 0 "[ . 1 ]"
93 CHI1 1 20 LYS N 1 20 LYS CA 1 20 LYS CB 1 20 LYS CG 150.00 90.00 -52.14 -53.03 -55.94 . . 0 "[ . 1 ]"
94 CHI2 1 20 LYS CA 1 20 LYS CB 1 20 LYS CG 1 20 LYS CD -90.00 -150.00 -65.21 -71.41 -78.25 3.40 12 0 "[ . 1 ]"
95 CHI2 1 20 LYS CA 1 20 LYS CB 1 20 LYS CG 1 20 LYS CD 30.00 -30.00 -65.21 -71.41 -78.25 . . 0 "[ . 1 ]"
96 CHI2 1 20 LYS CA 1 20 LYS CB 1 20 LYS CG 1 20 LYS CD 150.00 90.00 -65.21 -71.41 -78.25 . . 0 "[ . 1 ]"
97 CHI3 1 20 LYS CB 1 20 LYS CG 1 20 LYS CD 1 20 LYS CE -90.00 -150.00 -162.68 67.78 -74.42 . . 0 "[ . 1 ]"
98 CHI3 1 20 LYS CB 1 20 LYS CG 1 20 LYS CD 1 20 LYS CE 30.00 -30.00 -162.68 67.78 -74.42 . . 0 "[ . 1 ]"
99 CHI3 1 20 LYS CB 1 20 LYS CG 1 20 LYS CD 1 20 LYS CE 150.00 90.00 -162.68 67.78 -74.42 . . 0 "[ . 1 ]"
100 CHI4 1 20 LYS CG 1 20 LYS CD 1 20 LYS CE 1 20 LYS NZ -90.00 -150.00 -129.18 -90.90 -160.46 0.90 2 0 "[ . 1 ]"
101 CHI4 1 20 LYS CG 1 20 LYS CD 1 20 LYS CE 1 20 LYS NZ 30.00 -30.00 -129.18 -90.90 -160.46 . . 0 "[ . 1 ]"
102 CHI4 1 20 LYS CG 1 20 LYS CD 1 20 LYS CE 1 20 LYS NZ 150.00 90.00 -129.18 -90.90 -160.46 . . 0 "[ . 1 ]"
103 CHI1 1 21 LYS N 1 21 LYS CA 1 21 LYS CB 1 21 LYS CG -90.00 -150.00 -129.86 -81.16 -120.58 29.42 8 1 "[ . + 1 ]"
104 CHI1 1 21 LYS N 1 21 LYS CA 1 21 LYS CB 1 21 LYS CG 30.00 -30.00 -129.86 -81.16 -120.58 . . 0 "[ . 1 ]"
105 CHI1 1 21 LYS N 1 21 LYS CA 1 21 LYS CB 1 21 LYS CG 150.00 90.00 -129.86 -81.16 -120.58 . . 0 "[ . 1 ]"
106 CHI2 1 21 LYS CA 1 21 LYS CB 1 21 LYS CG 1 21 LYS CD -90.00 -150.00 -174.45 92.66 -153.98 . . 0 "[ . 1 ]"
107 CHI2 1 21 LYS CA 1 21 LYS CB 1 21 LYS CG 1 21 LYS CD 30.00 -30.00 -174.45 92.66 -153.98 . . 0 "[ . 1 ]"
108 CHI2 1 21 LYS CA 1 21 LYS CB 1 21 LYS CG 1 21 LYS CD 150.00 90.00 -174.45 92.66 -153.98 2.66 8 0 "[ . 1 ]"
109 CHI3 1 21 LYS CB 1 21 LYS CG 1 21 LYS CD 1 21 LYS CE -90.00 -150.00 70.78 -154.27 91.84 . . 0 "[ . 1 ]"
110 CHI3 1 21 LYS CB 1 21 LYS CG 1 21 LYS CD 1 21 LYS CE 30.00 -30.00 70.78 -154.27 91.84 . . 0 "[ . 1 ]"
111 CHI3 1 21 LYS CB 1 21 LYS CG 1 21 LYS CD 1 21 LYS CE 150.00 90.00 70.78 -154.27 91.84 1.84 8 0 "[ . 1 ]"
112 CHI4 1 21 LYS CG 1 21 LYS CD 1 21 LYS CE 1 21 LYS NZ -90.00 -150.00 136.55 59.37 -82.49 . . 0 "[ . 1 ]"
113 CHI4 1 21 LYS CG 1 21 LYS CD 1 21 LYS CE 1 21 LYS NZ 30.00 -30.00 136.55 59.37 -82.49 . . 0 "[ . 1 ]"
114 CHI4 1 21 LYS CG 1 21 LYS CD 1 21 LYS CE 1 21 LYS NZ 150.00 90.00 136.55 59.37 -82.49 1.10 9 0 "[ . 1 ]"
115 CHI1 1 22 LYS N 1 22 LYS CA 1 22 LYS CB 1 22 LYS CG -90.00 -150.00 123.96 59.07 -174.12 . . 0 "[ . 1 ]"
116 CHI1 1 22 LYS N 1 22 LYS CA 1 22 LYS CB 1 22 LYS CG 30.00 -30.00 123.96 59.07 -174.12 . . 0 "[ . 1 ]"
117 CHI1 1 22 LYS N 1 22 LYS CA 1 22 LYS CB 1 22 LYS CG 150.00 90.00 123.96 59.07 -174.12 . . 0 "[ . 1 ]"
118 CHI2 1 22 LYS CA 1 22 LYS CB 1 22 LYS CG 1 22 LYS CD -90.00 -150.00 155.24 -166.75 -178.51 4.73 10 0 "[ . 1 ]"
119 CHI2 1 22 LYS CA 1 22 LYS CB 1 22 LYS CG 1 22 LYS CD 30.00 -30.00 155.24 -166.75 -178.51 . . 0 "[ . 1 ]"
120 CHI2 1 22 LYS CA 1 22 LYS CB 1 22 LYS CG 1 22 LYS CD 150.00 90.00 155.24 -166.75 -178.51 18.26 6 2 "[ .+ 1 -]"
121 CHI3 1 22 LYS CB 1 22 LYS CG 1 22 LYS CD 1 22 LYS CE -90.00 -150.00 -165.48 161.71 134.61 16.08 10 3 "[ * . - + ]"
122 CHI3 1 22 LYS CB 1 22 LYS CG 1 22 LYS CD 1 22 LYS CE 30.00 -30.00 -165.48 161.71 134.61 . . 0 "[ . 1 ]"
123 CHI3 1 22 LYS CB 1 22 LYS CG 1 22 LYS CD 1 22 LYS CE 150.00 90.00 -165.48 161.71 134.61 26.35 4 2 "[- +. 1 ]"
124 CHI4 1 22 LYS CG 1 22 LYS CD 1 22 LYS CE 1 22 LYS NZ -90.00 -150.00 137.35 -165.43 94.21 7.65 10 1 "[ . + ]"
125 CHI4 1 22 LYS CG 1 22 LYS CD 1 22 LYS CE 1 22 LYS NZ 30.00 -30.00 137.35 -165.43 94.21 . . 0 "[ . 1 ]"
126 CHI4 1 22 LYS CG 1 22 LYS CD 1 22 LYS CE 1 22 LYS NZ 150.00 90.00 137.35 -165.43 94.21 4.21 4 0 "[ . 1 ]"
127 CHI1 1 23 GLN N 1 23 GLN CA 1 23 GLN CB 1 23 GLN CG -90.00 -150.00 -45.44 -52.93 75.16 . . 0 "[ . 1 ]"
128 CHI1 1 23 GLN N 1 23 GLN CA 1 23 GLN CB 1 23 GLN CG 30.00 -30.00 -45.44 -52.93 75.16 . . 0 "[ . 1 ]"
129 CHI1 1 23 GLN N 1 23 GLN CA 1 23 GLN CB 1 23 GLN CG 150.00 90.00 -45.44 -52.93 75.16 . . 0 "[ . 1 ]"
130 CHI2 1 23 GLN CA 1 23 GLN CB 1 23 GLN CG 1 23 GLN CD -90.00 -150.00 -67.55 -75.75 86.09 . . 0 "[ . 1 ]"
131 CHI2 1 23 GLN CA 1 23 GLN CB 1 23 GLN CG 1 23 GLN CD 30.00 -30.00 -67.55 -75.75 86.09 . . 0 "[ . 1 ]"
132 CHI2 1 23 GLN CA 1 23 GLN CB 1 23 GLN CG 1 23 GLN CD 150.00 90.00 -67.55 -75.75 86.09 . . 0 "[ . 1 ]"
133 CHI1 1 24 GLU N 1 24 GLU CA 1 24 GLU CB 1 24 GLU CG -90.00 -150.00 -57.30 61.52 -59.14 14.39 7 1 "[ . + 1 ]"
134 CHI1 1 24 GLU N 1 24 GLU CA 1 24 GLU CB 1 24 GLU CG 30.00 -30.00 -57.30 61.52 -59.14 . . 0 "[ . 1 ]"
135 CHI1 1 24 GLU N 1 24 GLU CA 1 24 GLU CB 1 24 GLU CG 150.00 90.00 -57.30 61.52 -59.14 . . 0 "[ . 1 ]"
136 CHI2 1 24 GLU CA 1 24 GLU CB 1 24 GLU CG 1 24 GLU CD -90.00 -150.00 -119.30 -175.72 174.40 . . 0 "[ . 1 ]"
137 CHI2 1 24 GLU CA 1 24 GLU CB 1 24 GLU CG 1 24 GLU CD 30.00 -30.00 -119.30 -175.72 174.40 . . 0 "[ . 1 ]"
138 CHI2 1 24 GLU CA 1 24 GLU CB 1 24 GLU CG 1 24 GLU CD 150.00 90.00 -119.30 -175.72 174.40 . . 0 "[ . 1 ]"
139 CHI1 1 25 GLN N 1 25 GLN CA 1 25 GLN CB 1 25 GLN CG -90.00 -150.00 -88.08 -104.70 148.85 14.70 7 1 "[ . + 1 ]"
140 CHI1 1 25 GLN N 1 25 GLN CA 1 25 GLN CB 1 25 GLN CG 30.00 -30.00 -88.08 -104.70 148.85 . . 0 "[ . 1 ]"
141 CHI1 1 25 GLN N 1 25 GLN CA 1 25 GLN CB 1 25 GLN CG 150.00 90.00 -88.08 -104.70 148.85 1.15 1 0 "[ . 1 ]"
142 CHI2 1 25 GLN CA 1 25 GLN CB 1 25 GLN CG 1 25 GLN CD -90.00 -150.00 170.58 -72.33 -156.73 . . 0 "[ . 1 ]"
143 CHI2 1 25 GLN CA 1 25 GLN CB 1 25 GLN CG 1 25 GLN CD 30.00 -30.00 170.58 -72.33 -156.73 . . 0 "[ . 1 ]"
144 CHI2 1 25 GLN CA 1 25 GLN CB 1 25 GLN CG 1 25 GLN CD 150.00 90.00 170.58 -72.33 -156.73 23.26 7 1 "[ . + 1 ]"
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