NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
429687 |
2jmh   |
7276 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2jmh
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 185
_TA_constraint_stats_list.Viol_count 686
_TA_constraint_stats_list.Viol_total 8333.33
_TA_constraint_stats_list.Viol_max 4.22
_TA_constraint_stats_list.Viol_rms 0.32
_TA_constraint_stats_list.Viol_average_all_restraints 0.10
_TA_constraint_stats_list.Viol_average_violations_only 0.58
_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 6 LYS N 1 6 LYS CA 1 6 LYS C 1 7 PRO N 72.00 180.00 159.84 159.19 157.66 . . 0 "[ . 1 . 2 ]"
2 PHI 1 10 ASP C 1 11 ASP N 1 11 ASP CA 1 11 ASP C -107.40 -28.60 -86.71 -106.72 -59.27 . . 0 "[ . 1 . 2 ]"
3 PSI 1 11 ASP N 1 11 ASP CA 1 11 ASP C 1 12 PHE N -64.20 32.20 -24.84 -33.29 -40.12 . . 0 "[ . 1 . 2 ]"
4 PHI 1 16 PHE C 1 17 ASP N 1 17 ASP CA 1 17 ASP C -72.20 -51.60 -61.92 -73.54 -51.79 1.34 17 0 "[ . 1 . 2 ]"
5 PSI 1 17 ASP N 1 17 ASP CA 1 17 ASP C 1 18 HIS N -56.40 -21.90 -40.50 -28.15 -30.55 . . 0 "[ . 1 . 2 ]"
6 PHI 1 20 LEU C 1 21 ILE N 1 21 ILE CA 1 21 ILE C -87.70 -47.10 -52.82 -54.16 -56.77 1.72 14 0 "[ . 1 . 2 ]"
7 PSI 1 21 ILE N 1 21 ILE CA 1 21 ILE C 1 22 GLU N -68.10 -7.70 -41.96 -57.85 -31.74 . . 0 "[ . 1 . 2 ]"
8 PHI 1 21 ILE C 1 22 GLU N 1 22 GLU CA 1 22 GLU C -78.60 -51.90 -54.65 -54.62 -57.03 1.48 12 0 "[ . 1 . 2 ]"
9 PSI 1 22 GLU N 1 22 GLU CA 1 22 GLU C 1 23 GLN N -53.00 -24.60 -52.69 -53.69 -53.72 1.85 6 0 "[ . 1 . 2 ]"
10 PHI 1 22 GLU C 1 23 GLN N 1 23 GLN CA 1 23 GLN C -75.40 -55.40 -62.60 -62.66 -63.21 . . 0 "[ . 1 . 2 ]"
11 PSI 1 23 GLN N 1 23 GLN CA 1 23 GLN C 1 24 ALA N -51.20 -26.20 -39.23 -37.94 -38.83 . . 0 "[ . 1 . 2 ]"
12 PHI 1 23 GLN C 1 24 ALA N 1 24 ALA CA 1 24 ALA C -75.50 -55.50 -63.03 -63.03 -63.54 . . 0 "[ . 1 . 2 ]"
13 PSI 1 24 ALA N 1 24 ALA CA 1 24 ALA C 1 25 ASN N -49.10 -28.60 -46.16 -47.95 -49.22 0.34 19 0 "[ . 1 . 2 ]"
14 PHI 1 24 ALA C 1 25 ASN N 1 25 ASN CA 1 25 ASN C -86.60 -49.90 -63.39 -66.43 -59.64 . . 0 "[ . 1 . 2 ]"
15 PSI 1 25 ASN N 1 25 ASN CA 1 25 ASN C 1 26 HIS N -48.90 -26.10 -41.58 -42.20 -42.39 . . 0 "[ . 1 . 2 ]"
16 PHI 1 25 ASN C 1 26 HIS N 1 26 HIS CA 1 26 HIS C -78.50 -58.50 -64.87 -65.31 -65.56 . . 0 "[ . 1 . 2 ]"
17 PSI 1 26 HIS N 1 26 HIS CA 1 26 HIS C 1 27 ALA N -63.00 -16.80 -40.40 -44.97 -35.88 . . 0 "[ . 1 . 2 ]"
18 PHI 1 26 HIS C 1 27 ALA N 1 27 ALA CA 1 27 ALA C -82.00 -55.50 -64.81 -64.76 -65.24 . . 0 "[ . 1 . 2 ]"
19 PSI 1 27 ALA N 1 27 ALA CA 1 27 ALA C 1 28 ILE N -50.40 -21.10 -51.24 -52.13 -50.65 1.73 20 0 "[ . 1 . 2 ]"
20 PHI 1 27 ALA C 1 28 ILE N 1 28 ILE CA 1 28 ILE C -72.70 -51.60 -64.29 -64.27 -64.35 . . 0 "[ . 1 . 2 ]"
21 PSI 1 28 ILE N 1 28 ILE CA 1 28 ILE C 1 29 GLU N -56.90 -31.90 -32.53 -32.85 -33.22 0.26 15 0 "[ . 1 . 2 ]"
22 PHI 1 28 ILE C 1 29 GLU N 1 29 GLU CA 1 29 GLU C -73.10 -50.70 -66.21 -65.95 -66.19 . . 0 "[ . 1 . 2 ]"
23 PSI 1 29 GLU N 1 29 GLU CA 1 29 GLU C 1 30 LYS N -58.70 -18.50 -55.02 -58.91 -47.66 0.21 4 0 "[ . 1 . 2 ]"
24 PHI 1 29 GLU C 1 30 LYS N 1 30 LYS CA 1 30 LYS C -75.70 -55.70 -59.93 -57.73 -58.33 . . 0 "[ . 1 . 2 ]"
25 PSI 1 30 LYS N 1 30 LYS CA 1 30 LYS C 1 31 GLY N -51.60 -28.10 -45.95 -48.73 -50.51 0.57 4 0 "[ . 1 . 2 ]"
26 PHI 1 30 LYS C 1 31 GLY N 1 31 GLY CA 1 31 GLY C -83.90 -52.10 -63.62 -71.80 -54.08 . . 0 "[ . 1 . 2 ]"
27 PSI 1 31 GLY N 1 31 GLY CA 1 31 GLY C 1 32 GLU N -53.60 -27.90 -39.32 -46.30 -49.78 . . 0 "[ . 1 . 2 ]"
28 PHI 1 31 GLY C 1 32 GLU N 1 32 GLU CA 1 32 GLU C -77.60 -50.00 -65.81 -69.98 -54.95 . . 0 "[ . 1 . 2 ]"
29 PSI 1 32 GLU N 1 32 GLU CA 1 32 GLU C 1 33 HIS N -63.90 -16.90 -41.14 -41.22 -41.80 . . 0 "[ . 1 . 2 ]"
30 PHI 1 32 GLU C 1 33 HIS N 1 33 HIS CA 1 33 HIS C -77.30 -55.20 -66.12 -70.65 -55.16 0.04 1 0 "[ . 1 . 2 ]"
31 PSI 1 33 HIS N 1 33 HIS CA 1 33 HIS C 1 34 GLN N -52.60 -32.60 -52.43 -54.52 -47.00 1.92 20 0 "[ . 1 . 2 ]"
32 PHI 1 33 HIS C 1 34 GLN N 1 34 GLN CA 1 34 GLN C -77.90 -57.70 -61.13 -68.04 -57.33 0.37 1 0 "[ . 1 . 2 ]"
33 PSI 1 34 GLN N 1 34 GLN CA 1 34 GLN C 1 35 LEU N -61.00 -14.10 -36.08 -39.31 -40.83 . . 0 "[ . 1 . 2 ]"
34 PHI 1 34 GLN C 1 35 LEU N 1 35 LEU CA 1 35 LEU C -76.80 -50.70 -67.02 -76.00 -59.07 . . 0 "[ . 1 . 2 ]"
35 PSI 1 35 LEU N 1 35 LEU CA 1 35 LEU C 1 36 LEU N -51.80 -31.80 -49.42 -46.62 -46.79 0.55 13 0 "[ . 1 . 2 ]"
36 PHI 1 35 LEU C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -73.20 -53.10 -58.72 -64.77 -53.85 . . 0 "[ . 1 . 2 ]"
37 PSI 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 TYR N -51.20 -24.70 -42.24 -51.35 -31.74 0.15 4 0 "[ . 1 . 2 ]"
38 PHI 1 36 LEU C 1 37 TYR N 1 37 TYR CA 1 37 TYR C -76.30 -56.30 -71.44 -75.37 -64.36 . . 0 "[ . 1 . 2 ]"
39 PSI 1 37 TYR N 1 37 TYR CA 1 37 TYR C 1 38 LEU N -57.60 -31.80 -38.61 -33.54 -33.61 0.33 5 0 "[ . 1 . 2 ]"
40 PHI 1 37 TYR C 1 38 LEU N 1 38 LEU CA 1 38 LEU C -76.50 -45.90 -67.34 -69.34 -61.00 . . 0 "[ . 1 . 2 ]"
41 PSI 1 38 LEU N 1 38 LEU CA 1 38 LEU C 1 39 GLN N -51.30 -31.30 -29.90 -30.79 -28.10 3.20 15 0 "[ . 1 . 2 ]"
42 PHI 1 38 LEU C 1 39 GLN N 1 39 GLN CA 1 39 GLN C -76.40 -53.20 -51.36 -51.74 -51.79 2.89 7 0 "[ . 1 . 2 ]"
43 PSI 1 39 GLN N 1 39 GLN CA 1 39 GLN C 1 40 HIS N -56.00 -23.60 -37.97 -41.44 -43.96 . . 0 "[ . 1 . 2 ]"
44 PHI 1 39 GLN C 1 40 HIS N 1 40 HIS CA 1 40 HIS C -80.10 -52.30 -62.59 -65.62 -57.72 . . 0 "[ . 1 . 2 ]"
45 PSI 1 40 HIS N 1 40 HIS CA 1 40 HIS C 1 41 GLN N -54.50 -28.00 -53.76 -52.15 -53.05 0.52 13 0 "[ . 1 . 2 ]"
46 PHI 1 40 HIS C 1 41 GLN N 1 41 GLN CA 1 41 GLN C -79.60 -47.90 -55.34 -54.70 -55.27 . . 0 "[ . 1 . 2 ]"
47 PSI 1 41 GLN N 1 41 GLN CA 1 41 GLN C 1 42 LEU N -54.40 -26.90 -40.96 -46.04 -36.48 . . 0 "[ . 1 . 2 ]"
48 PHI 1 41 GLN C 1 42 LEU N 1 42 LEU CA 1 42 LEU C -77.50 -50.50 -63.35 -64.45 -64.62 . . 0 "[ . 1 . 2 ]"
49 PSI 1 42 LEU N 1 42 LEU CA 1 42 LEU C 1 43 ASP N -55.50 -27.80 -49.79 -55.27 -42.29 . . 0 "[ . 1 . 2 ]"
50 PHI 1 42 LEU C 1 43 ASP N 1 43 ASP CA 1 43 ASP C -74.20 -54.20 -55.16 -59.52 -61.69 0.91 13 0 "[ . 1 . 2 ]"
51 PSI 1 43 ASP N 1 43 ASP CA 1 43 ASP C 1 44 GLU N -51.50 -27.40 -44.96 -51.80 -37.13 0.30 16 0 "[ . 1 . 2 ]"
52 PHI 1 43 ASP C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -76.20 -56.20 -72.16 -75.23 -67.79 . . 0 "[ . 1 . 2 ]"
53 PSI 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 LEU N -54.70 -29.00 -31.65 -36.82 -39.53 1.85 16 0 "[ . 1 . 2 ]"
54 PHI 1 44 GLU C 1 45 LEU N 1 45 LEU CA 1 45 LEU C -77.60 -51.40 -69.62 -69.67 -69.78 . . 0 "[ . 1 . 2 ]"
55 PSI 1 45 LEU N 1 45 LEU CA 1 45 LEU C 1 46 ASN N -51.10 -30.90 -31.42 -37.82 -29.58 1.32 11 0 "[ . 1 . 2 ]"
56 PHI 1 45 LEU C 1 46 ASN N 1 46 ASN CA 1 46 ASN C -84.50 -48.20 -54.95 -60.08 -51.24 . . 0 "[ . 1 . 2 ]"
57 PSI 1 46 ASN N 1 46 ASN CA 1 46 ASN C 1 47 GLU N -52.20 -19.00 -43.82 -44.68 -45.45 0.25 11 0 "[ . 1 . 2 ]"
58 PHI 1 46 ASN C 1 47 GLU N 1 47 GLU CA 1 47 GLU C -89.90 -54.70 -89.95 -90.28 -90.31 0.84 18 0 "[ . 1 . 2 ]"
59 PSI 1 47 GLU N 1 47 GLU CA 1 47 GLU C 1 48 ASN N -47.30 -18.60 -46.91 -47.46 -47.48 0.61 15 0 "[ . 1 . 2 ]"
60 PHI 1 47 GLU C 1 48 ASN N 1 48 ASN CA 1 48 ASN C -135.00 -44.90 -54.63 -57.93 -51.77 . . 0 "[ . 1 . 2 ]"
61 PSI 1 48 ASN N 1 48 ASN CA 1 48 ASN C 1 49 LYS N -35.80 17.50 -36.02 -36.41 -36.46 1.94 18 0 "[ . 1 . 2 ]"
62 PHI 1 49 LYS C 1 50 SER N 1 50 SER CA 1 50 SER C -146.50 -27.60 -73.83 -75.90 -65.02 . . 0 "[ . 1 . 2 ]"
63 PSI 1 50 SER N 1 50 SER CA 1 50 SER C 1 51 LYS N 97.40 164.60 124.22 106.32 133.85 . . 0 "[ . 1 . 2 ]"
64 PHI 1 50 SER C 1 51 LYS N 1 51 LYS CA 1 51 LYS C -67.60 -47.60 -60.71 -59.74 -60.73 0.59 13 0 "[ . 1 . 2 ]"
65 PSI 1 51 LYS N 1 51 LYS CA 1 51 LYS C 1 52 GLU N -56.30 -9.30 -41.56 -37.36 -39.05 . . 0 "[ . 1 . 2 ]"
66 PHI 1 51 LYS C 1 52 GLU N 1 52 GLU CA 1 52 GLU C -75.20 -52.00 -67.84 -68.59 -68.87 1.79 14 0 "[ . 1 . 2 ]"
67 PSI 1 52 GLU N 1 52 GLU CA 1 52 GLU C 1 53 LEU N -52.90 -19.50 -48.74 -53.21 -53.39 0.62 13 0 "[ . 1 . 2 ]"
68 PHI 1 52 GLU C 1 53 LEU N 1 53 LEU CA 1 53 LEU C -74.10 -54.10 -58.82 -65.58 -53.85 0.25 8 0 "[ . 1 . 2 ]"
69 PSI 1 53 LEU N 1 53 LEU CA 1 53 LEU C 1 54 GLN N -52.80 -32.80 -37.57 -36.41 -36.87 . . 0 "[ . 1 . 2 ]"
70 PHI 1 53 LEU C 1 54 GLN N 1 54 GLN CA 1 54 GLN C -69.10 -49.10 -69.51 -73.32 -63.98 4.22 15 0 "[ . 1 . 2 ]"
71 PSI 1 54 GLN N 1 54 GLN CA 1 54 GLN C 1 55 GLU N -61.20 -33.10 -52.84 -61.48 -31.66 1.44 16 0 "[ . 1 . 2 ]"
72 PHI 1 54 GLN C 1 55 GLU N 1 55 GLU CA 1 55 GLU C -73.20 -53.10 -57.67 -72.34 -52.29 0.81 6 0 "[ . 1 . 2 ]"
73 PSI 1 55 GLU N 1 55 GLU CA 1 55 GLU C 1 56 LYS N -50.10 -30.10 -32.55 -30.78 -31.75 0.92 9 0 "[ . 1 . 2 ]"
74 PHI 1 55 GLU C 1 56 LYS N 1 56 LYS CA 1 56 LYS C -74.50 -54.50 -73.94 -77.14 -69.82 2.64 11 0 "[ . 1 . 2 ]"
75 PSI 1 56 LYS N 1 56 LYS CA 1 56 LYS C 1 57 ILE N -55.40 -31.30 -51.74 -55.96 -41.76 0.56 9 0 "[ . 1 . 2 ]"
76 PHI 1 56 LYS C 1 57 ILE N 1 57 ILE CA 1 57 ILE C -77.10 -52.50 -58.82 -65.58 -52.09 0.41 14 0 "[ . 1 . 2 ]"
77 PSI 1 57 ILE N 1 57 ILE CA 1 57 ILE C 1 58 ILE N -56.20 -32.60 -46.23 -53.28 -36.87 . . 0 "[ . 1 . 2 ]"
78 PHI 1 57 ILE C 1 58 ILE N 1 58 ILE CA 1 58 ILE C -74.50 -54.50 -57.95 -61.86 -62.18 0.45 15 0 "[ . 1 . 2 ]"
79 PSI 1 58 ILE N 1 58 ILE CA 1 58 ILE C 1 59 ARG N -53.40 -32.90 -39.86 -49.44 -33.24 . . 0 "[ . 1 . 2 ]"
80 PHI 1 58 ILE C 1 59 ARG N 1 59 ARG CA 1 59 ARG C -73.40 -53.40 -66.24 -61.54 -63.17 . . 0 "[ . 1 . 2 ]"
81 PSI 1 59 ARG N 1 59 ARG CA 1 59 ARG C 1 60 GLU N -52.30 -26.60 -53.04 -54.45 -52.19 2.15 11 0 "[ . 1 . 2 ]"
82 PHI 1 59 ARG C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -76.30 -56.30 -61.31 -60.28 -60.70 0.32 18 0 "[ . 1 . 2 ]"
83 PSI 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 LEU N -52.60 -29.00 -46.32 -53.34 -38.81 0.74 18 0 "[ . 1 . 2 ]"
84 PHI 1 60 GLU C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -74.40 -54.40 -64.17 -61.42 -63.34 . . 0 "[ . 1 . 2 ]"
85 PSI 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 ASP N -51.30 -31.30 -35.05 -44.98 -30.30 1.00 8 0 "[ . 1 . 2 ]"
86 PHI 1 61 LEU C 1 62 ASP N 1 62 ASP CA 1 62 ASP C -75.00 -55.00 -65.68 -62.17 -63.90 . . 0 "[ . 1 . 2 ]"
87 PSI 1 62 ASP N 1 62 ASP CA 1 62 ASP C 1 63 VAL N -53.20 -28.70 -53.99 -52.20 -52.95 1.86 8 0 "[ . 1 . 2 ]"
88 PHI 1 62 ASP C 1 63 VAL N 1 63 VAL CA 1 63 VAL C -77.00 -57.00 -60.45 -59.14 -60.45 0.67 6 0 "[ . 1 . 2 ]"
89 PSI 1 63 VAL N 1 63 VAL CA 1 63 VAL C 1 64 VAL N -52.70 -32.70 -43.50 -53.13 -36.53 0.43 18 0 "[ . 1 . 2 ]"
90 PHI 1 63 VAL C 1 64 VAL N 1 64 VAL CA 1 64 VAL C -74.20 -53.50 -65.25 -63.41 -65.21 . . 0 "[ . 1 . 2 ]"
91 PSI 1 64 VAL N 1 64 VAL CA 1 64 VAL C 1 65 CYS N -55.80 -34.10 -56.47 -57.87 -55.30 2.07 2 0 "[ . 1 . 2 ]"
92 PHI 1 64 VAL C 1 65 CYS N 1 65 CYS CA 1 65 CYS C -70.60 -50.60 -58.07 -55.88 -57.69 . . 0 "[ . 1 . 2 ]"
93 PSI 1 65 CYS N 1 65 CYS CA 1 65 CYS C 1 66 ALA N -53.40 -28.10 -28.11 -30.96 -26.61 1.49 4 0 "[ . 1 . 2 ]"
94 PHI 1 65 CYS C 1 66 ALA N 1 66 ALA CA 1 66 ALA C -72.20 -51.10 -71.11 -72.04 -72.17 0.46 13 0 "[ . 1 . 2 ]"
95 PSI 1 66 ALA N 1 66 ALA CA 1 66 ALA C 1 67 MET N -58.00 -25.70 -58.34 -58.70 -57.92 0.70 11 0 "[ . 1 . 2 ]"
96 PHI 1 66 ALA C 1 67 MET N 1 67 MET CA 1 67 MET C -77.80 -57.80 -61.87 -63.64 -59.64 . . 0 "[ . 1 . 2 ]"
97 PSI 1 67 MET N 1 67 MET CA 1 67 MET C 1 68 ILE N -56.50 -24.70 -35.90 -39.64 -32.77 . . 0 "[ . 1 . 2 ]"
98 PHI 1 67 MET C 1 68 ILE N 1 68 ILE CA 1 68 ILE C -88.80 -44.60 -69.21 -70.27 -70.83 . . 0 "[ . 1 . 2 ]"
99 PSI 1 68 ILE N 1 68 ILE CA 1 68 ILE C 1 69 GLU N -52.80 -28.70 -47.55 -49.02 -45.54 . . 0 "[ . 1 . 2 ]"
100 PHI 1 68 ILE C 1 69 GLU N 1 69 GLU CA 1 69 GLU C -74.10 -49.30 -58.96 -59.11 -59.30 . . 0 "[ . 1 . 2 ]"
101 PSI 1 69 GLU N 1 69 GLU CA 1 69 GLU C 1 70 GLY N -52.50 -22.70 -49.09 -52.91 -40.14 0.41 10 0 "[ . 1 . 2 ]"
102 PHI 1 69 GLU C 1 70 GLY N 1 70 GLY CA 1 70 GLY C -84.00 -54.00 -64.61 -64.83 -65.62 . . 0 "[ . 1 . 2 ]"
103 PSI 1 70 GLY N 1 70 GLY CA 1 70 GLY C 1 71 ALA N -52.40 -28.40 -48.40 -44.61 -46.20 0.43 12 0 "[ . 1 . 2 ]"
104 PHI 1 70 GLY C 1 71 ALA N 1 71 ALA CA 1 71 ALA C -73.50 -52.10 -60.90 -69.46 -52.21 . . 0 "[ . 1 . 2 ]"
105 PSI 1 71 ALA N 1 71 ALA CA 1 71 ALA C 1 72 GLN N -55.90 -28.70 -52.26 -56.75 -41.09 0.85 18 0 "[ . 1 . 2 ]"
106 PHI 1 71 ALA C 1 72 GLN N 1 72 GLN CA 1 72 GLN C -73.40 -53.40 -58.74 -65.07 -53.91 . . 0 "[ . 1 . 2 ]"
107 PSI 1 72 GLN N 1 72 GLN CA 1 72 GLN C 1 73 GLY N -52.60 -23.40 -44.92 -53.04 -32.20 0.44 11 0 "[ . 1 . 2 ]"
108 PHI 1 72 GLN C 1 73 GLY N 1 73 GLY CA 1 73 GLY C -84.70 -52.20 -59.49 -66.41 -53.93 . . 0 "[ . 1 . 2 ]"
109 PSI 1 73 GLY N 1 73 GLY CA 1 73 GLY C 1 74 ALA N -51.50 -26.40 -49.68 -52.90 -33.37 1.40 13 0 "[ . 1 . 2 ]"
110 PHI 1 73 GLY C 1 74 ALA N 1 74 ALA CA 1 74 ALA C -79.20 -51.80 -65.46 -70.90 -59.32 . . 0 "[ . 1 . 2 ]"
111 PSI 1 74 ALA N 1 74 ALA CA 1 74 ALA C 1 75 LEU N -61.50 -16.70 -50.57 -55.29 -56.39 0.58 15 0 "[ . 1 . 2 ]"
112 PHI 1 74 ALA C 1 75 LEU N 1 75 LEU CA 1 75 LEU C -71.00 -50.30 -56.51 -51.59 -51.64 . . 0 "[ . 1 . 2 ]"
113 PSI 1 75 LEU N 1 75 LEU CA 1 75 LEU C 1 76 GLU N -55.50 -35.10 -48.87 -49.45 -50.92 0.58 5 0 "[ . 1 . 2 ]"
114 PHI 1 75 LEU C 1 76 GLU N 1 76 GLU CA 1 76 GLU C -76.30 -54.30 -60.23 -69.69 -54.01 0.29 19 0 "[ . 1 . 2 ]"
115 PSI 1 76 GLU N 1 76 GLU CA 1 76 GLU C 1 77 ARG N -52.00 -30.70 -48.87 -52.33 -37.51 0.33 4 0 "[ . 1 . 2 ]"
116 PHI 1 76 GLU C 1 77 ARG N 1 77 ARG CA 1 77 ARG C -74.30 -54.30 -63.33 -64.43 -65.57 . . 0 "[ . 1 . 2 ]"
117 PSI 1 77 ARG N 1 77 ARG CA 1 77 ARG C 1 78 GLU N -53.70 -26.90 -27.96 -32.23 -26.03 0.87 19 0 "[ . 1 . 2 ]"
118 PHI 1 77 ARG C 1 78 GLU N 1 78 GLU CA 1 78 GLU C -77.50 -52.90 -76.90 -78.71 -70.32 1.21 13 0 "[ . 1 . 2 ]"
119 PSI 1 78 GLU N 1 78 GLU CA 1 78 GLU C 1 79 LEU N -54.20 -23.40 -53.38 -54.72 -46.59 0.52 13 0 "[ . 1 . 2 ]"
120 PHI 1 78 GLU C 1 79 LEU N 1 79 LEU CA 1 79 LEU C -83.40 -50.20 -65.97 -64.73 -64.99 . . 0 "[ . 1 . 2 ]"
121 PSI 1 79 LEU N 1 79 LEU CA 1 79 LEU C 1 80 LYS N -46.80 -10.40 -27.10 -28.97 -31.12 . . 0 "[ . 1 . 2 ]"
122 PHI 1 79 LEU C 1 80 LYS N 1 80 LYS CA 1 80 LYS C -98.40 -47.80 -64.39 -64.40 -65.18 . . 0 "[ . 1 . 2 ]"
123 PSI 1 80 LYS N 1 80 LYS CA 1 80 LYS C 1 81 ARG N -65.50 -10.70 -15.34 -22.44 -12.69 . . 0 "[ . 1 . 2 ]"
124 PHI 1 80 LYS C 1 81 ARG N 1 81 ARG CA 1 81 ARG C -91.50 -51.20 -60.41 -83.38 -50.94 0.26 16 0 "[ . 1 . 2 ]"
125 PSI 1 81 ARG N 1 81 ARG CA 1 81 ARG C 1 82 THR N -58.60 -13.60 -36.56 -42.24 -46.49 0.14 19 0 "[ . 1 . 2 ]"
126 PHI 1 85 ASN C 1 86 ILE N 1 86 ILE CA 1 86 ILE C -72.10 -52.10 -60.01 -64.21 -52.72 . . 0 "[ . 1 . 2 ]"
127 PSI 1 86 ILE N 1 86 ILE CA 1 86 ILE C 1 87 LEU N -56.50 -8.80 -56.23 -56.89 -56.96 0.94 18 0 "[ . 1 . 2 ]"
128 PHI 1 86 ILE C 1 87 LEU N 1 87 LEU CA 1 87 LEU C -79.10 -47.30 -61.95 -61.09 -61.75 . . 0 "[ . 1 . 2 ]"
129 PSI 1 87 LEU N 1 87 LEU CA 1 87 LEU C 1 88 GLU N -50.80 -25.40 -47.88 -50.90 -45.08 0.10 15 0 "[ . 1 . 2 ]"
130 PHI 1 87 LEU C 1 88 GLU N 1 88 GLU CA 1 88 GLU C -72.80 -50.80 -57.91 -57.40 -57.57 . . 0 "[ . 1 . 2 ]"
131 PSI 1 88 GLU N 1 88 GLU CA 1 88 GLU C 1 89 ARG N -55.20 -27.60 -42.33 -41.96 -42.32 . . 0 "[ . 1 . 2 ]"
132 PHI 1 88 GLU C 1 89 ARG N 1 89 ARG CA 1 89 ARG C -70.10 -50.10 -63.14 -66.21 -57.27 . . 0 "[ . 1 . 2 ]"
133 PSI 1 89 ARG N 1 89 ARG CA 1 89 ARG C 1 90 PHE N -53.10 -33.10 -46.03 -46.20 -46.57 . . 0 "[ . 1 . 2 ]"
134 PHI 1 89 ARG C 1 90 PHE N 1 90 PHE CA 1 90 PHE C -74.70 -54.70 -58.97 -60.86 -56.62 . . 0 "[ . 1 . 2 ]"
135 PSI 1 90 PHE N 1 90 PHE CA 1 90 PHE C 1 91 ASN N -55.40 -30.00 -55.86 -56.72 -55.48 1.32 19 0 "[ . 1 . 2 ]"
136 PHI 1 90 PHE C 1 91 ASN N 1 91 ASN CA 1 91 ASN C -72.30 -52.30 -59.02 -57.64 -58.19 . . 0 "[ . 1 . 2 ]"
137 PSI 1 91 ASN N 1 91 ASN CA 1 91 ASN C 1 92 TYR N -52.80 -32.80 -42.44 -44.34 -44.38 . . 0 "[ . 1 . 2 ]"
138 PHI 1 91 ASN C 1 92 TYR N 1 92 TYR CA 1 92 TYR C -76.10 -56.10 -62.56 -65.27 -57.72 . . 0 "[ . 1 . 2 ]"
139 PSI 1 92 TYR N 1 92 TYR CA 1 92 TYR C 1 93 GLU N -53.70 -30.30 -46.03 -53.86 -41.07 0.16 19 0 "[ . 1 . 2 ]"
140 PHI 1 92 TYR C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -83.60 -51.20 -57.88 -56.00 -56.94 . . 0 "[ . 1 . 2 ]"
141 PSI 1 93 GLU N 1 93 GLU CA 1 93 GLU C 1 94 GLU N -54.20 -18.90 -54.22 -54.82 -49.30 0.62 6 0 "[ . 1 . 2 ]"
142 PHI 1 93 GLU C 1 94 GLU N 1 94 GLU CA 1 94 GLU C -77.80 -57.80 -61.05 -61.28 -62.24 . . 0 "[ . 1 . 2 ]"
143 PSI 1 94 GLU N 1 94 GLU CA 1 94 GLU C 1 95 ALA N -55.10 -26.50 -45.46 -49.61 -33.36 . . 0 "[ . 1 . 2 ]"
144 PHI 1 94 GLU C 1 95 ALA N 1 95 ALA CA 1 95 ALA C -78.70 -51.60 -52.65 -52.59 -54.64 0.29 12 0 "[ . 1 . 2 ]"
145 PSI 1 95 ALA N 1 95 ALA CA 1 95 ALA C 1 96 GLN N -56.90 -27.40 -51.56 -52.42 -54.30 1.35 19 0 "[ . 1 . 2 ]"
146 PHI 1 95 ALA C 1 96 GLN N 1 96 GLN CA 1 96 GLN C -77.70 -54.40 -65.16 -67.17 -59.73 . . 0 "[ . 1 . 2 ]"
147 PSI 1 96 GLN N 1 96 GLN CA 1 96 GLN C 1 97 THR N -55.30 -25.40 -36.18 -46.39 -31.19 . . 0 "[ . 1 . 2 ]"
148 PHI 1 96 GLN C 1 97 THR N 1 97 THR CA 1 97 THR C -81.00 -49.00 -59.03 -61.54 -63.12 . . 0 "[ . 1 . 2 ]"
149 PSI 1 97 THR N 1 97 THR CA 1 97 THR C 1 98 LEU N -51.20 -31.20 -52.22 -52.20 -52.31 1.83 19 0 "[ . 1 . 2 ]"
150 PHI 1 97 THR C 1 98 LEU N 1 98 LEU CA 1 98 LEU C -75.30 -54.10 -65.50 -67.23 -59.81 . . 0 "[ . 1 . 2 ]"
151 PSI 1 98 LEU N 1 98 LEU CA 1 98 LEU C 1 99 SER N -49.30 -29.30 -43.18 -47.35 -38.73 . . 0 "[ . 1 . 2 ]"
152 PHI 1 98 LEU C 1 99 SER N 1 99 SER CA 1 99 SER C -84.70 -49.60 -59.79 -57.48 -58.57 . . 0 "[ . 1 . 2 ]"
153 PSI 1 99 SER N 1 99 SER CA 1 99 SER C 1 100 LYS N -52.00 -23.70 -44.27 -44.90 -45.57 . . 0 "[ . 1 . 2 ]"
154 PHI 1 99 SER C 1 100 LYS N 1 100 LYS CA 1 100 LYS C -76.20 -56.20 -63.41 -66.68 -58.32 . . 0 "[ . 1 . 2 ]"
155 PSI 1 100 LYS N 1 100 LYS CA 1 100 LYS C 1 101 ILE N -50.10 -26.10 -49.73 -50.64 -45.63 0.54 18 0 "[ . 1 . 2 ]"
156 PHI 1 100 LYS C 1 101 ILE N 1 101 ILE CA 1 101 ILE C -76.90 -56.90 -57.14 -56.69 -56.78 0.71 11 0 "[ . 1 . 2 ]"
157 PSI 1 101 ILE N 1 101 ILE CA 1 101 ILE C 1 102 LEU N -55.40 -34.90 -50.15 -51.55 -55.59 2.01 20 0 "[ . 1 . 2 ]"
158 PHI 1 101 ILE C 1 102 LEU N 1 102 LEU CA 1 102 LEU C -70.20 -50.20 -59.22 -57.78 -57.97 . . 0 "[ . 1 . 2 ]"
159 PSI 1 102 LEU N 1 102 LEU CA 1 102 LEU C 1 103 LEU N -51.10 -31.10 -43.35 -51.06 -30.59 0.51 1 0 "[ . 1 . 2 ]"
160 PHI 1 102 LEU C 1 103 LEU N 1 103 LEU CA 1 103 LEU C -74.50 -54.50 -57.97 -58.01 -63.99 0.09 3 0 "[ . 1 . 2 ]"
161 PSI 1 103 LEU N 1 103 LEU CA 1 103 LEU C 1 104 LYS N -55.20 -27.70 -47.69 -47.68 -48.45 . . 0 "[ . 1 . 2 ]"
162 PHI 1 103 LEU C 1 104 LYS N 1 104 LYS CA 1 104 LYS C -74.90 -54.90 -59.66 -59.32 -59.62 . . 0 "[ . 1 . 2 ]"
163 PSI 1 104 LYS N 1 104 LYS CA 1 104 LYS C 1 105 ASP N -56.10 -27.30 -51.70 -56.16 -46.93 0.06 4 0 "[ . 1 . 2 ]"
164 PHI 1 104 LYS C 1 105 ASP N 1 105 ASP CA 1 105 ASP C -74.40 -54.40 -56.30 -56.36 -57.13 0.20 14 0 "[ . 1 . 2 ]"
165 PSI 1 105 ASP N 1 105 ASP CA 1 105 ASP C 1 106 LEU N -57.00 -23.70 -44.76 -44.68 -45.11 . . 0 "[ . 1 . 2 ]"
166 PHI 1 105 ASP C 1 106 LEU N 1 106 LEU CA 1 106 LEU C -73.90 -50.20 -59.57 -66.03 -56.56 . . 0 "[ . 1 . 2 ]"
167 PSI 1 106 LEU N 1 106 LEU CA 1 106 LEU C 1 107 LYS N -56.00 -32.20 -48.08 -56.63 -31.97 0.63 20 0 "[ . 1 . 2 ]"
168 PHI 1 106 LEU C 1 107 LYS N 1 107 LYS CA 1 107 LYS C -81.30 -51.90 -57.02 -55.01 -55.40 0.26 19 0 "[ . 1 . 2 ]"
169 PSI 1 107 LYS N 1 107 LYS CA 1 107 LYS C 1 108 GLU N -57.20 -13.60 -47.00 -45.76 -46.95 . . 0 "[ . 1 . 2 ]"
170 PHI 1 107 LYS C 1 108 GLU N 1 108 GLU CA 1 108 GLU C -75.10 -54.90 -59.60 -65.90 -54.82 0.08 9 0 "[ . 1 . 2 ]"
171 PSI 1 108 GLU N 1 108 GLU CA 1 108 GLU C 1 109 THR N -68.20 -12.90 -46.39 -43.51 -46.22 . . 0 "[ . 1 . 2 ]"
172 PHI 1 108 GLU C 1 109 THR N 1 109 THR CA 1 109 THR C -76.00 -50.60 -57.73 -63.54 -51.54 . . 0 "[ . 1 . 2 ]"
173 PSI 1 109 THR N 1 109 THR CA 1 109 THR C 1 110 GLU N -53.00 -33.00 -51.75 -54.04 -45.67 1.04 2 0 "[ . 1 . 2 ]"
174 PHI 1 109 THR C 1 110 GLU N 1 110 GLU CA 1 110 GLU C -71.50 -51.50 -57.22 -62.44 -53.75 . . 0 "[ . 1 . 2 ]"
175 PSI 1 110 GLU N 1 110 GLU CA 1 110 GLU C 1 111 GLN N -56.90 -27.30 -45.78 -42.67 -44.39 . . 0 "[ . 1 . 2 ]"
176 PHI 1 110 GLU C 1 111 GLN N 1 111 GLN CA 1 111 GLN C -70.00 -50.00 -56.99 -67.30 -49.71 0.29 16 0 "[ . 1 . 2 ]"
177 PSI 1 111 GLN N 1 111 GLN CA 1 111 GLN C 1 112 LYS N -55.00 -31.40 -48.72 -53.88 -36.24 . . 0 "[ . 1 . 2 ]"
178 PHI 1 111 GLN C 1 112 LYS N 1 112 LYS CA 1 112 LYS C -73.30 -53.30 -59.09 -69.57 -53.16 0.14 9 0 "[ . 1 . 2 ]"
179 PSI 1 112 LYS N 1 112 LYS CA 1 112 LYS C 1 113 VAL N -48.20 -28.20 -48.23 -48.78 -49.00 2.84 18 0 "[ . 1 . 2 ]"
180 PHI 1 112 LYS C 1 113 VAL N 1 113 VAL CA 1 113 VAL C -76.20 -56.20 -58.08 -65.65 -55.28 0.92 15 0 "[ . 1 . 2 ]"
181 PSI 1 113 VAL N 1 113 VAL CA 1 113 VAL C 1 114 LYS N -60.10 -27.30 -45.45 -35.79 -38.92 . . 0 "[ . 1 . 2 ]"
182 PHI 1 113 VAL C 1 114 LYS N 1 114 LYS CA 1 114 LYS C -77.30 -48.90 -68.85 -77.40 -59.63 0.10 18 0 "[ . 1 . 2 ]"
183 PSI 1 114 LYS N 1 114 LYS CA 1 114 LYS C 1 115 ASP N -55.20 -14.90 -28.38 -34.57 -21.56 . . 0 "[ . 1 . 2 ]"
184 PHI 1 117 GLN C 1 118 THR N 1 118 THR CA 1 118 THR C -149.40 -48.00 -146.16 -146.16 -146.84 0.24 6 0 "[ . 1 . 2 ]"
185 PSI 1 118 THR N 1 118 THR CA 1 118 THR C 1 119 GLN N 105.50 -157.70 175.38 160.49 -173.81 . . 0 "[ . 1 . 2 ]"
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