NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
476382 |
1dgq   |
4553 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1dgq
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 291
_TA_constraint_stats_list.Viol_count 26
_TA_constraint_stats_list.Viol_total 515.33
_TA_constraint_stats_list.Viol_max 3.31
_TA_constraint_stats_list.Viol_rms 0.08
_TA_constraint_stats_list.Viol_average_all_restraints 0.00
_TA_constraint_stats_list.Viol_average_violations_only 0.90
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * ID of the restraint list.
* 3 * Number of restraints in list.
* 4 * Number of violated restraints (each model violation is used).
* 5 * Sum of violations in degrees.
* 6 * Maximum violation of a restraint without averaging in any way.
* 7 * Rms of violations over all restraints.
* 8 * Average violation over all restraints.
* 9 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
Threshold for reporting violations (degrees) in the last columns of the next table.
* 10 * This tag.
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
* 2 * Torsion angle name where available.
* 3 * First atom's:
* 4 * Chain identifier (can be absent if none defined)
* 5 * Residue number
* 6 * Residue name
* 7 * Name of (pseudo-)atom
* 8 * Second thru fourth atom's identifiers occupy columns 7 thru 18.
* 19 * Lower bound (degrees)
* 20 * Upper bound (degrees)
* 21 * Average angle in ensemble of models
* 22 * Minimum angle in ensemble of models (counter clockwise from range)
* 23 * Maximum angle in ensemble of models (clockwise from range)
* 24 * Maximum violation (without any averaging)
* 25 * Model number with the maximum violation
* 26 * Number of models with a violation above cutoff
* 27 * List of models with a violation above cutoff. See description above.
* 28 * Administrative tag
* 29 * Administrative tag
;
loop_
_TA_constraint_stats.Restraint_ID
_TA_constraint_stats.Torsion_angle_name
_TA_constraint_stats.Entity_assembly_ID_1
_TA_constraint_stats.Comp_index_ID_1
_TA_constraint_stats.Comp_ID_1
_TA_constraint_stats.Atom_ID_1
_TA_constraint_stats.Entity_assembly_ID_2
_TA_constraint_stats.Comp_index_ID_2
_TA_constraint_stats.Comp_ID_2
_TA_constraint_stats.Atom_ID_2
_TA_constraint_stats.Entity_assembly_ID_3
_TA_constraint_stats.Comp_index_ID_3
_TA_constraint_stats.Comp_ID_3
_TA_constraint_stats.Atom_ID_3
_TA_constraint_stats.Entity_assembly_ID_4
_TA_constraint_stats.Comp_index_ID_4
_TA_constraint_stats.Comp_ID_4
_TA_constraint_stats.Atom_ID_4
_TA_constraint_stats.Angle_lower_bound_val
_TA_constraint_stats.Angle_upper_bound_val
_TA_constraint_stats.Angle_average
_TA_constraint_stats.Angle_minimum
_TA_constraint_stats.Angle_maximum
_TA_constraint_stats.Max_violation
_TA_constraint_stats.Max_violation_model_number
_TA_constraint_stats.Over_cutoff_violation_count
_TA_constraint_stats.Over_cutoff_violation_per_model
1 . 1 157 LYS N 1 157 LYS CA 1 157 LYS C 1 158 PRO N 80.00 -160.00 146.82 146.67 146.41 . . 0 "[ . 1 . 2 ]"
2 . 1 156 SER C 1 157 LYS N 1 157 LYS CA 1 157 LYS C -180.00 -60.00 -103.27 -99.99 -101.34 . . 0 "[ . 1 . 2 ]"
3 . 1 7 VAL N 1 7 VAL CA 1 7 VAL C 1 8 ASP N 60.00 -150.00 125.22 114.23 142.98 . . 0 "[ . 1 . 2 ]"
4 . 1 8 ASP N 1 8 ASP CA 1 8 ASP C 1 9 LEU N 80.00 -160.00 100.40 105.31 103.56 . . 0 "[ . 1 . 2 ]"
5 . 1 9 LEU N 1 9 LEU CA 1 9 LEU C 1 10 VAL N 80.00 -160.00 107.38 106.91 106.65 . . 0 "[ . 1 . 2 ]"
6 . 1 10 VAL N 1 10 VAL CA 1 10 VAL C 1 11 PHE N 80.00 -160.00 116.63 114.13 127.61 . . 0 "[ . 1 . 2 ]"
7 . 1 11 PHE N 1 11 PHE CA 1 11 PHE C 1 12 LEU N 80.00 -160.00 101.23 100.75 100.58 . . 0 "[ . 1 . 2 ]"
8 . 1 12 LEU N 1 12 LEU CA 1 12 LEU C 1 13 PHE N 80.00 -160.00 87.48 87.47 87.03 . . 0 "[ . 1 . 2 ]"
9 . 1 13 PHE N 1 13 PHE CA 1 13 PHE C 1 14 ASP N 80.00 -160.00 131.90 134.31 133.97 . . 0 "[ . 1 . 2 ]"
10 . 1 14 ASP N 1 14 ASP CA 1 14 ASP C 1 15 GLY N 80.00 -160.00 137.78 133.27 148.18 . . 0 "[ . 1 . 2 ]"
11 . 1 21 PRO N 1 21 PRO CA 1 21 PRO C 1 22 ASP N -90.00 80.00 -56.48 -61.39 -44.35 . . 0 "[ . 1 . 2 ]"
12 . 1 22 ASP N 1 22 ASP CA 1 22 ASP C 1 23 GLU N -90.00 0.00 -39.59 -43.36 -33.44 . . 0 "[ . 1 . 2 ]"
13 . 1 23 GLU N 1 23 GLU CA 1 23 GLU C 1 24 PHE N -90.00 0.00 -48.13 -45.89 -47.04 . . 0 "[ . 1 . 2 ]"
14 . 1 24 PHE N 1 24 PHE CA 1 24 PHE C 1 25 GLN N -90.00 0.00 -44.31 -48.06 -39.24 . . 0 "[ . 1 . 2 ]"
15 . 1 25 GLN N 1 25 GLN CA 1 25 GLN C 1 26 LYS N -90.00 0.00 -38.09 -39.03 -39.72 . . 0 "[ . 1 . 2 ]"
16 . 1 26 LYS N 1 26 LYS CA 1 26 LYS C 1 27 ILE N -90.00 0.00 -38.47 -39.04 -39.23 . . 0 "[ . 1 . 2 ]"
17 . 1 27 ILE N 1 27 ILE CA 1 27 ILE C 1 28 LEU N -90.00 0.00 -48.22 -48.27 -48.37 . . 0 "[ . 1 . 2 ]"
18 . 1 28 LEU N 1 28 LEU CA 1 28 LEU C 1 29 ASP N -90.00 0.00 -50.09 -53.04 -48.97 . . 0 "[ . 1 . 2 ]"
19 . 1 29 ASP N 1 29 ASP CA 1 29 ASP C 1 30 PHE N -90.00 0.00 -45.95 -47.03 -47.46 . . 0 "[ . 1 . 2 ]"
20 . 1 30 PHE N 1 30 PHE CA 1 30 PHE C 1 31 MET N -90.00 0.00 -56.31 -55.80 -55.89 . . 0 "[ . 1 . 2 ]"
21 . 1 31 MET N 1 31 MET CA 1 31 MET C 1 32 LYS N -90.00 0.00 -52.48 -50.42 -51.23 . . 0 "[ . 1 . 2 ]"
22 . 1 32 LYS N 1 32 LYS CA 1 32 LYS C 1 33 ASP N -90.00 0.00 -46.48 -50.09 -41.24 . . 0 "[ . 1 . 2 ]"
23 . 1 33 ASP N 1 33 ASP CA 1 33 ASP C 1 34 VAL N -90.00 0.00 -54.23 -57.81 -46.02 . . 0 "[ . 1 . 2 ]"
24 . 1 34 VAL N 1 34 VAL CA 1 34 VAL C 1 35 MET N -90.00 0.00 -50.81 -53.28 -48.92 . . 0 "[ . 1 . 2 ]"
25 . 1 35 MET N 1 35 MET CA 1 35 MET C 1 36 LYS N -90.00 0.00 -45.71 -53.29 -32.84 . . 0 "[ . 1 . 2 ]"
26 . 1 36 LYS N 1 36 LYS CA 1 36 LYS C 1 37 LYS N -90.00 0.00 -54.76 -56.10 -57.12 . . 0 "[ . 1 . 2 ]"
27 . 1 37 LYS N 1 37 LYS CA 1 37 LYS C 1 38 LEU N -90.00 0.00 -45.03 -54.18 -32.81 . . 0 "[ . 1 . 2 ]"
28 . 1 44 GLN N 1 44 GLN CA 1 44 GLN C 1 45 PHE N 60.00 -150.00 115.37 101.46 139.32 . . 0 "[ . 1 . 2 ]"
29 . 1 45 PHE N 1 45 PHE CA 1 45 PHE C 1 46 ALA N 80.00 -160.00 154.16 155.47 155.19 . . 0 "[ . 1 . 2 ]"
30 . 1 46 ALA N 1 46 ALA CA 1 46 ALA C 1 47 ALA N 80.00 -160.00 157.84 158.01 157.76 . . 0 "[ . 1 . 2 ]"
31 . 1 47 ALA N 1 47 ALA CA 1 47 ALA C 1 48 VAL N 80.00 -160.00 132.89 133.11 131.54 . . 0 "[ . 1 . 2 ]"
32 . 1 48 VAL N 1 48 VAL CA 1 48 VAL C 1 49 GLN N 80.00 -160.00 114.60 116.99 115.89 . . 0 "[ . 1 . 2 ]"
33 . 1 49 GLN N 1 49 GLN CA 1 49 GLN C 1 50 PHE N 80.00 -160.00 141.70 134.88 156.99 . . 0 "[ . 1 . 2 ]"
34 . 1 50 PHE N 1 50 PHE CA 1 50 PHE C 1 51 SER N 60.00 -150.00 153.07 143.81 159.92 . . 0 "[ . 1 . 2 ]"
35 . 1 55 LYS N 1 55 LYS CA 1 55 LYS C 1 56 THR N 60.00 -150.00 105.79 101.43 100.74 . . 0 "[ . 1 . 2 ]"
36 . 1 59 ASP N 1 59 ASP CA 1 59 ASP C 1 60 PHE N 60.00 -150.00 -179.82 -179.99 179.13 . . 0 "[ . 1 . 2 ]"
37 . 1 60 PHE N 1 60 PHE CA 1 60 PHE C 1 61 SER N -90.00 0.00 -52.84 -57.78 -48.86 . . 0 "[ . 1 . 2 ]"
38 . 1 61 SER N 1 61 SER CA 1 61 SER C 1 62 ASP N -90.00 0.00 -44.53 -45.76 -47.77 . . 0 "[ . 1 . 2 ]"
39 . 1 62 ASP N 1 62 ASP CA 1 62 ASP C 1 63 TYR N -90.00 0.00 -53.53 -55.48 -49.76 . . 0 "[ . 1 . 2 ]"
40 . 1 63 TYR N 1 63 TYR CA 1 63 TYR C 1 64 VAL N -90.00 0.00 -49.73 -54.33 -45.22 . . 0 "[ . 1 . 2 ]"
41 . 1 64 VAL N 1 64 VAL CA 1 64 VAL C 1 65 LYS N -90.00 0.00 -41.78 -45.68 -38.72 . . 0 "[ . 1 . 2 ]"
42 . 1 65 LYS N 1 65 LYS CA 1 65 LYS C 1 66 TRP N -90.00 0.00 -57.93 -56.56 -57.21 . . 0 "[ . 1 . 2 ]"
43 . 1 67 LYS N 1 67 LYS CA 1 67 LYS C 1 68 ASP N -90.00 80.00 25.58 -13.11 48.09 . . 0 "[ . 1 . 2 ]"
44 . 1 68 ASP N 1 68 ASP CA 1 68 ASP C 1 69 PRO N 60.00 -150.00 111.33 101.46 117.04 . . 0 "[ . 1 . 2 ]"
45 . 1 69 PRO N 1 69 PRO CA 1 69 PRO C 1 70 ASP N -90.00 80.00 -46.11 -50.90 -42.00 . . 0 "[ . 1 . 2 ]"
46 . 1 70 ASP N 1 70 ASP CA 1 70 ASP C 1 71 ALA N -90.00 0.00 -45.32 -51.78 -40.68 . . 0 "[ . 1 . 2 ]"
47 . 1 71 ALA N 1 71 ALA CA 1 71 ALA C 1 72 LEU N -90.00 0.00 -49.04 -53.64 -53.84 . . 0 "[ . 1 . 2 ]"
48 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 LEU N -90.00 80.00 -37.97 -57.09 -30.84 . . 0 "[ . 1 . 2 ]"
49 . 1 73 LEU N 1 73 LEU CA 1 73 LEU C 1 74 LYS N -90.00 80.00 -7.39 -18.26 1.65 . . 0 "[ . 1 . 2 ]"
50 . 1 74 LYS N 1 74 LYS CA 1 74 LYS C 1 75 HIS N -90.00 0.00 -27.84 -33.38 -21.36 . . 0 "[ . 1 . 2 ]"
51 . 1 75 HIS N 1 75 HIS CA 1 75 HIS C 1 76 VAL N -90.00 80.00 -14.02 -14.52 -16.04 . . 0 "[ . 1 . 2 ]"
52 . 1 77 LYS N 1 77 LYS CA 1 77 LYS C 1 78 HIS N 60.00 -150.00 107.60 90.64 114.41 . . 0 "[ . 1 . 2 ]"
53 . 1 85 THR N 1 85 THR CA 1 85 THR C 1 86 PHE N -90.00 0.00 -46.75 -53.75 -43.21 . . 0 "[ . 1 . 2 ]"
54 . 1 86 PHE N 1 86 PHE CA 1 86 PHE C 1 87 GLY N -90.00 0.00 -55.11 -61.26 -45.26 . . 0 "[ . 1 . 2 ]"
55 . 1 87 GLY N 1 87 GLY CA 1 87 GLY C 1 88 ALA N -90.00 0.00 -39.72 -37.20 -38.12 . . 0 "[ . 1 . 2 ]"
56 . 1 88 ALA N 1 88 ALA CA 1 88 ALA C 1 89 ILE N -90.00 0.00 -38.78 -37.65 -38.08 . . 0 "[ . 1 . 2 ]"
57 . 1 89 ILE N 1 89 ILE CA 1 89 ILE C 1 90 ASN N -90.00 0.00 -49.31 -48.54 -48.93 . . 0 "[ . 1 . 2 ]"
58 . 1 90 ASN N 1 90 ASN CA 1 90 ASN C 1 91 TYR N -90.00 0.00 -48.16 -50.97 -45.75 . . 0 "[ . 1 . 2 ]"
59 . 1 91 TYR N 1 91 TYR CA 1 91 TYR C 1 92 VAL N -90.00 0.00 -55.21 -57.27 -53.51 . . 0 "[ . 1 . 2 ]"
60 . 1 92 VAL N 1 92 VAL CA 1 92 VAL C 1 93 ALA N -90.00 0.00 -53.06 -56.24 -49.84 . . 0 "[ . 1 . 2 ]"
61 . 1 93 ALA N 1 93 ALA CA 1 93 ALA C 1 94 THR N -90.00 0.00 -45.88 -45.89 -46.34 . . 0 "[ . 1 . 2 ]"
62 . 1 94 THR N 1 94 THR CA 1 94 THR C 1 95 GLU N -90.00 80.00 -46.04 -51.64 -42.18 . . 0 "[ . 1 . 2 ]"
63 . 1 98 ARG N 1 98 ARG CA 1 98 ARG C 1 99 GLU N 60.00 -150.00 137.89 129.14 143.56 . . 0 "[ . 1 . 2 ]"
64 . 1 100 GLU N 1 100 GLU CA 1 100 GLU C 1 101 LEU N -90.00 0.00 -35.69 -45.85 -32.82 . . 0 "[ . 1 . 2 ]"
65 . 1 110 VAL N 1 110 VAL CA 1 110 VAL C 1 111 LEU N 60.00 -150.00 127.50 120.78 132.60 . . 0 "[ . 1 . 2 ]"
66 . 1 111 LEU N 1 111 LEU CA 1 111 LEU C 1 112 ILE N 80.00 -160.00 100.80 101.27 100.29 . . 0 "[ . 1 . 2 ]"
67 . 1 112 ILE N 1 112 ILE CA 1 112 ILE C 1 113 ILE N 80.00 -160.00 103.16 104.65 103.99 . . 0 "[ . 1 . 2 ]"
68 . 1 113 ILE N 1 113 ILE CA 1 113 ILE C 1 114 ILE N 80.00 -160.00 126.72 126.43 124.25 . . 0 "[ . 1 . 2 ]"
69 . 1 114 ILE N 1 114 ILE CA 1 114 ILE C 1 115 THR N 80.00 -160.00 112.79 107.34 120.92 . . 0 "[ . 1 . 2 ]"
70 . 1 115 THR N 1 115 THR CA 1 115 THR C 1 116 ASP N 80.00 -160.00 145.20 142.49 142.11 . . 0 "[ . 1 . 2 ]"
71 . 1 124 ASN N 1 124 ASN CA 1 124 ASN C 1 125 ILE N 60.00 -150.00 169.79 170.92 168.36 . . 0 "[ . 1 . 2 ]"
72 . 1 126 ASP N 1 126 ASP CA 1 126 ASP C 1 127 ALA N -90.00 0.00 -40.84 -40.84 -41.91 . . 0 "[ . 1 . 2 ]"
73 . 1 127 ALA N 1 127 ALA CA 1 127 ALA C 1 128 ALA N -90.00 0.00 -33.34 -35.42 -31.35 . . 0 "[ . 1 . 2 ]"
74 . 1 129 LYS N 1 129 LYS CA 1 129 LYS C 1 130 ASP N -90.00 0.00 -38.51 -45.52 -35.38 . . 0 "[ . 1 . 2 ]"
75 . 1 133 ARG N 1 133 ARG CA 1 133 ARG C 1 134 TYR N 60.00 -150.00 92.17 90.56 87.39 . . 0 "[ . 1 . 2 ]"
76 . 1 134 TYR N 1 134 TYR CA 1 134 TYR C 1 135 ILE N 80.00 -160.00 136.69 138.32 137.80 . . 0 "[ . 1 . 2 ]"
77 . 1 135 ILE N 1 135 ILE CA 1 135 ILE C 1 136 ILE N 80.00 -160.00 125.77 116.19 137.40 . . 0 "[ . 1 . 2 ]"
78 . 1 136 ILE N 1 136 ILE CA 1 136 ILE C 1 137 GLY N 80.00 -160.00 113.01 111.13 110.75 . . 0 "[ . 1 . 2 ]"
79 . 1 137 GLY N 1 137 GLY CA 1 137 GLY C 1 138 ILE N 80.00 -160.00 103.60 102.00 101.64 . . 0 "[ . 1 . 2 ]"
80 . 1 138 ILE N 1 138 ILE CA 1 138 ILE C 1 139 GLY N 60.00 -150.00 135.76 121.79 140.31 . . 0 "[ . 1 . 2 ]"
81 . 1 140 LYS N 1 140 LYS CA 1 140 LYS C 1 141 HIS N -90.00 80.00 -59.68 -62.01 -63.50 . . 0 "[ . 1 . 2 ]"
82 . 1 144 THR N 1 144 THR CA 1 144 THR C 1 145 LYS N 60.00 -150.00 118.45 124.44 122.75 . . 0 "[ . 1 . 2 ]"
83 . 1 145 LYS N 1 145 LYS CA 1 145 LYS C 1 146 GLU N -90.00 0.00 -44.81 -47.69 -49.41 . . 0 "[ . 1 . 2 ]"
84 . 1 146 GLU N 1 146 GLU CA 1 146 GLU C 1 147 SER N -90.00 0.00 -41.38 -46.18 -38.68 . . 0 "[ . 1 . 2 ]"
85 . 1 147 SER N 1 147 SER CA 1 147 SER C 1 148 GLN N -90.00 0.00 -46.92 -55.20 -41.50 . . 0 "[ . 1 . 2 ]"
86 . 1 148 GLN N 1 148 GLN CA 1 148 GLN C 1 149 GLU N -90.00 0.00 -48.75 -47.54 -48.24 . . 0 "[ . 1 . 2 ]"
87 . 1 149 GLU N 1 149 GLU CA 1 149 GLU C 1 150 THR N -90.00 0.00 -33.61 -32.70 -33.54 . . 0 "[ . 1 . 2 ]"
88 . 1 150 THR N 1 150 THR CA 1 150 THR C 1 151 LEU N -90.00 0.00 -43.64 -48.79 -35.33 . . 0 "[ . 1 . 2 ]"
89 . 1 150 THR N 1 150 THR CA 1 150 THR C 1 151 LEU N -90.00 0.00 -43.64 -48.79 -35.33 . . 0 "[ . 1 . 2 ]"
90 . 1 159 ALA N 1 159 ALA CA 1 159 ALA C 1 160 SER N -90.00 0.00 -30.76 -33.79 -26.96 . . 0 "[ . 1 . 2 ]"
91 . 1 160 SER N 1 160 SER CA 1 160 SER C 1 161 GLU N -90.00 0.00 -34.46 -35.54 -35.77 . . 0 "[ . 1 . 2 ]"
92 . 1 163 VAL N 1 163 VAL CA 1 163 VAL C 1 164 LYS N 60.00 -150.00 129.09 131.33 129.59 . . 0 "[ . 1 . 2 ]"
93 . 1 164 LYS N 1 164 LYS CA 1 164 LYS C 1 165 ILE N 80.00 -160.00 106.75 106.68 106.48 . . 0 "[ . 1 . 2 ]"
94 . 1 165 ILE N 1 165 ILE CA 1 165 ILE C 1 166 LEU N 80.00 -160.00 104.50 78.88 132.71 1.12 16 0 "[ . 1 . 2 ]"
95 . 1 166 LEU N 1 166 LEU CA 1 166 LEU C 1 167 ASP N 60.00 -150.00 100.99 83.03 136.55 . . 0 "[ . 1 . 2 ]"
96 . 1 168 THR N 1 168 THR CA 1 168 THR C 1 169 PHE N 60.00 -150.00 154.07 148.11 160.55 . . 0 "[ . 1 . 2 ]"
97 . 1 170 GLU N 1 170 GLU CA 1 170 GLU C 1 171 LYS N -90.00 0.00 -44.61 -50.81 -40.99 . . 0 "[ . 1 . 2 ]"
98 . 1 172 LEU N 1 172 LEU CA 1 172 LEU C 1 173 LYS N -90.00 0.00 -34.13 -34.19 -34.94 . . 0 "[ . 1 . 2 ]"
99 . 1 175 LEU N 1 175 LEU CA 1 175 LEU C 1 176 PHE N -90.00 0.00 -49.56 -47.82 -49.29 . . 0 "[ . 1 . 2 ]"
100 . 1 176 PHE N 1 176 PHE CA 1 176 PHE C 1 177 THR N -90.00 0.00 -53.25 -51.76 -52.10 . . 0 "[ . 1 . 2 ]"
101 . 1 177 THR N 1 177 THR CA 1 177 THR C 1 178 GLU N -90.00 0.00 -46.33 -46.36 -46.77 . . 0 "[ . 1 . 2 ]"
102 . 1 178 GLU N 1 178 GLU CA 1 178 GLU C 1 179 LEU N -90.00 0.00 -48.07 -56.40 -34.92 . . 0 "[ . 1 . 2 ]"
103 . 1 179 LEU N 1 179 LEU CA 1 179 LEU C 1 180 GLN N -90.00 0.00 -44.58 -34.43 -37.78 . . 0 "[ . 1 . 2 ]"
104 . 1 180 GLN N 1 180 GLN CA 1 180 GLN C 1 181 LYS N -90.00 0.00 -46.40 -47.35 -48.60 . . 0 "[ . 1 . 2 ]"
105 . 1 181 LYS N 1 181 LYS CA 1 181 LYS C 1 182 LYS N -90.00 0.00 -48.56 -40.40 -42.87 . . 0 "[ . 1 . 2 ]"
106 . 1 182 LYS N 1 182 LYS CA 1 182 LYS C 1 183 ILE N -90.00 0.00 -51.24 -54.74 -56.37 . . 0 "[ . 1 . 2 ]"
107 . 1 183 ILE N 1 183 ILE CA 1 183 ILE C 1 184 TYR N -90.00 0.00 -40.41 -55.61 -35.49 . . 0 "[ . 1 . 2 ]"
108 . 1 6 ASN C 1 7 VAL N 1 7 VAL CA 1 7 VAL C 160.00 -40.00 -140.90 -145.11 -134.44 . . 0 "[ . 1 . 2 ]"
109 . 1 7 VAL C 1 8 ASP N 1 8 ASP CA 1 8 ASP C -180.00 -60.00 -96.21 -88.22 -89.98 . . 0 "[ . 1 . 2 ]"
110 . 1 8 ASP C 1 9 LEU N 1 9 LEU CA 1 9 LEU C -180.00 -60.00 -100.56 -107.19 -94.16 . . 0 "[ . 1 . 2 ]"
111 . 1 9 LEU C 1 10 VAL N 1 10 VAL CA 1 10 VAL C -180.00 -60.00 -92.81 -96.50 -85.59 . . 0 "[ . 1 . 2 ]"
112 . 1 10 VAL C 1 11 PHE N 1 11 PHE CA 1 11 PHE C -180.00 -60.00 -85.04 -83.79 -83.97 . . 0 "[ . 1 . 2 ]"
113 . 1 11 PHE C 1 12 LEU N 1 12 LEU CA 1 12 LEU C -180.00 -60.00 -91.10 -94.94 -86.96 . . 0 "[ . 1 . 2 ]"
114 . 1 12 LEU C 1 13 PHE N 1 13 PHE CA 1 13 PHE C -180.00 -60.00 -104.05 -104.01 -104.13 . . 0 "[ . 1 . 2 ]"
115 . 1 13 PHE C 1 14 ASP N 1 14 ASP CA 1 14 ASP C -180.00 -60.00 -77.20 -80.33 -81.27 . . 0 "[ . 1 . 2 ]"
116 . 1 21 PRO C 1 22 ASP N 1 22 ASP CA 1 22 ASP C -100.00 -20.00 -56.17 -55.21 -55.32 . . 0 "[ . 1 . 2 ]"
117 . 1 22 ASP C 1 23 GLU N 1 23 GLU CA 1 23 GLU C -100.00 -20.00 -67.92 -73.99 -62.58 . . 0 "[ . 1 . 2 ]"
118 . 1 23 GLU C 1 24 PHE N 1 24 PHE CA 1 24 PHE C -100.00 -20.00 -58.33 -60.31 -61.45 . . 0 "[ . 1 . 2 ]"
119 . 1 24 PHE C 1 25 GLN N 1 25 GLN CA 1 25 GLN C -100.00 -20.00 -55.24 -55.94 -56.17 . . 0 "[ . 1 . 2 ]"
120 . 1 25 GLN C 1 26 LYS N 1 26 LYS CA 1 26 LYS C -100.00 -20.00 -67.79 -72.37 -58.62 . . 0 "[ . 1 . 2 ]"
121 . 1 26 LYS C 1 27 ILE N 1 27 ILE CA 1 27 ILE C -100.00 -20.00 -55.66 -59.64 -54.09 . . 0 "[ . 1 . 2 ]"
122 . 1 27 ILE C 1 28 LEU N 1 28 LEU CA 1 28 LEU C -100.00 -20.00 -57.53 -56.55 -56.64 . . 0 "[ . 1 . 2 ]"
123 . 1 28 LEU C 1 29 ASP N 1 29 ASP CA 1 29 ASP C -100.00 -20.00 -53.68 -53.30 -53.35 . . 0 "[ . 1 . 2 ]"
124 . 1 29 ASP C 1 30 PHE N 1 30 PHE CA 1 30 PHE C -100.00 -20.00 -54.24 -56.99 -52.48 . . 0 "[ . 1 . 2 ]"
125 . 1 30 PHE C 1 31 MET N 1 31 MET CA 1 31 MET C -100.00 -20.00 -57.68 -59.36 -55.27 . . 0 "[ . 1 . 2 ]"
126 . 1 31 MET C 1 32 LYS N 1 32 LYS CA 1 32 LYS C -100.00 -20.00 -48.29 -50.66 -45.48 . . 0 "[ . 1 . 2 ]"
127 . 1 32 LYS C 1 33 ASP N 1 33 ASP CA 1 33 ASP C -100.00 -20.00 -59.58 -58.25 -58.58 . . 0 "[ . 1 . 2 ]"
128 . 1 33 ASP C 1 34 VAL N 1 34 VAL CA 1 34 VAL C -100.00 -20.00 -53.04 -57.62 -49.73 . . 0 "[ . 1 . 2 ]"
129 . 1 34 VAL C 1 35 MET N 1 35 MET CA 1 35 MET C -100.00 -20.00 -58.12 -58.03 -58.20 . . 0 "[ . 1 . 2 ]"
130 . 1 35 MET C 1 36 LYS N 1 36 LYS CA 1 36 LYS C -100.00 -20.00 -58.02 -67.04 -54.11 . . 0 "[ . 1 . 2 ]"
131 . 1 36 LYS C 1 37 LYS N 1 37 LYS CA 1 37 LYS C -100.00 -20.00 -56.92 -69.09 -51.03 . . 0 "[ . 1 . 2 ]"
132 . 1 43 TYR C 1 44 GLN N 1 44 GLN CA 1 44 GLN C 160.00 -40.00 -87.59 -118.00 -74.33 . . 0 "[ . 1 . 2 ]"
133 . 1 44 GLN C 1 45 PHE N 1 45 PHE CA 1 45 PHE C -180.00 -60.00 -96.96 -99.36 -106.61 . . 0 "[ . 1 . 2 ]"
134 . 1 45 PHE C 1 46 ALA N 1 46 ALA CA 1 46 ALA C -180.00 -60.00 -141.45 -146.15 -135.01 . . 0 "[ . 1 . 2 ]"
135 . 1 46 ALA C 1 47 ALA N 1 47 ALA CA 1 47 ALA C -180.00 -60.00 -140.68 -145.93 -138.56 . . 0 "[ . 1 . 2 ]"
136 . 1 47 ALA C 1 48 VAL N 1 48 VAL CA 1 48 VAL C -180.00 -60.00 -118.92 -125.10 -115.21 . . 0 "[ . 1 . 2 ]"
137 . 1 48 VAL C 1 49 GLN N 1 49 GLN CA 1 49 GLN C -180.00 -60.00 -75.29 -78.40 -72.44 . . 0 "[ . 1 . 2 ]"
138 . 1 49 GLN C 1 50 PHE N 1 50 PHE CA 1 50 PHE C 160.00 -40.00 -136.32 -137.52 -139.68 . . 0 "[ . 1 . 2 ]"
139 . 1 54 TYR C 1 55 LYS N 1 55 LYS CA 1 55 LYS C 160.00 -40.00 -147.77 -145.28 -145.68 . . 0 "[ . 1 . 2 ]"
140 . 1 58 PHE C 1 59 ASP N 1 59 ASP CA 1 59 ASP C 160.00 -40.00 -111.26 -114.01 -115.11 . . 0 "[ . 1 . 2 ]"
141 . 1 59 ASP C 1 60 PHE N 1 60 PHE CA 1 60 PHE C -100.00 -20.00 -55.19 -59.11 -49.33 . . 0 "[ . 1 . 2 ]"
142 . 1 60 PHE C 1 61 SER N 1 61 SER CA 1 61 SER C -100.00 -20.00 -53.63 -58.70 -48.28 . . 0 "[ . 1 . 2 ]"
143 . 1 61 SER C 1 62 ASP N 1 62 ASP CA 1 62 ASP C -100.00 -20.00 -56.68 -54.99 -55.13 . . 0 "[ . 1 . 2 ]"
144 . 1 62 ASP C 1 63 TYR N 1 63 TYR CA 1 63 TYR C -100.00 -20.00 -54.37 -51.82 -52.94 . . 0 "[ . 1 . 2 ]"
145 . 1 63 TYR C 1 64 VAL N 1 64 VAL CA 1 64 VAL C -100.00 -20.00 -57.17 -60.51 -54.10 . . 0 "[ . 1 . 2 ]"
146 . 1 64 VAL C 1 65 LYS N 1 65 LYS CA 1 65 LYS C -100.00 -20.00 -67.19 -64.53 -65.39 . . 0 "[ . 1 . 2 ]"
147 . 1 66 TRP C 1 67 LYS N 1 67 LYS CA 1 67 LYS C -120.00 100.00 52.07 42.90 63.71 . . 0 "[ . 1 . 2 ]"
148 . 1 67 LYS C 1 68 ASP N 1 68 ASP CA 1 68 ASP C 160.00 -40.00 -131.52 -145.79 -147.39 . . 0 "[ . 1 . 2 ]"
149 . 1 68 ASP C 1 69 PRO N 1 69 PRO CA 1 69 PRO C -120.00 100.00 -54.71 -50.16 -59.85 . . 0 "[ . 1 . 2 ]"
150 . 1 69 PRO C 1 70 ASP N 1 70 ASP CA 1 70 ASP C -100.00 -20.00 -59.10 -61.08 -57.35 . . 0 "[ . 1 . 2 ]"
151 . 1 70 ASP C 1 71 ALA N 1 71 ALA CA 1 71 ALA C -100.00 -20.00 -60.13 -61.43 -61.85 . . 0 "[ . 1 . 2 ]"
152 . 1 71 ALA C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -120.00 100.00 -62.62 -57.86 -58.05 . . 0 "[ . 1 . 2 ]"
153 . 1 72 LEU C 1 73 LEU N 1 73 LEU CA 1 73 LEU C -120.00 100.00 -84.30 -82.79 -82.92 . . 0 "[ . 1 . 2 ]"
154 . 1 73 LEU C 1 74 LYS N 1 74 LYS CA 1 74 LYS C -100.00 -20.00 -54.19 -59.21 -47.75 . . 0 "[ . 1 . 2 ]"
155 . 1 74 LYS C 1 75 HIS N 1 75 HIS CA 1 75 HIS C -120.00 100.00 -67.69 -79.45 -63.62 . . 0 "[ . 1 . 2 ]"
156 . 1 76 VAL C 1 77 LYS N 1 77 LYS CA 1 77 LYS C 160.00 -40.00 -99.25 -97.89 -112.02 . . 0 "[ . 1 . 2 ]"
157 . 1 84 ASN C 1 85 THR N 1 85 THR CA 1 85 THR C -100.00 -20.00 -62.84 -66.97 -59.78 . . 0 "[ . 1 . 2 ]"
158 . 1 85 THR C 1 86 PHE N 1 86 PHE CA 1 86 PHE C -100.00 -20.00 -59.12 -54.01 -64.24 . . 0 "[ . 1 . 2 ]"
159 . 1 86 PHE C 1 87 GLY N 1 87 GLY CA 1 87 GLY C -100.00 -20.00 -59.77 -61.24 -56.46 . . 0 "[ . 1 . 2 ]"
160 . 1 87 GLY C 1 88 ALA N 1 88 ALA CA 1 88 ALA C -100.00 -20.00 -66.75 -69.87 -64.59 . . 0 "[ . 1 . 2 ]"
161 . 1 88 ALA C 1 89 ILE N 1 89 ILE CA 1 89 ILE C -100.00 -20.00 -60.56 -60.76 -60.80 . . 0 "[ . 1 . 2 ]"
162 . 1 89 ILE C 1 90 ASN N 1 90 ASN CA 1 90 ASN C -100.00 -20.00 -56.71 -56.80 -57.38 . . 0 "[ . 1 . 2 ]"
163 . 1 90 ASN C 1 91 TYR N 1 91 TYR CA 1 91 TYR C -100.00 -20.00 -52.01 -51.73 -51.84 . . 0 "[ . 1 . 2 ]"
164 . 1 91 TYR C 1 92 VAL N 1 92 VAL CA 1 92 VAL C -100.00 -20.00 -53.49 -52.98 -53.28 . . 0 "[ . 1 . 2 ]"
165 . 1 92 VAL C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -100.00 -20.00 -49.30 -50.99 -45.60 . . 0 "[ . 1 . 2 ]"
166 . 1 93 ALA C 1 94 THR N 1 94 THR CA 1 94 THR C -120.00 100.00 -97.47 -103.28 -92.95 . . 0 "[ . 1 . 2 ]"
167 . 1 97 PHE C 1 98 ARG N 1 98 ARG CA 1 98 ARG C 160.00 -40.00 -131.78 -130.95 -132.04 . . 0 "[ . 1 . 2 ]"
168 . 1 99 GLU C 1 100 GLU N 1 100 GLU CA 1 100 GLU C -100.00 -20.00 -53.88 -58.34 -41.66 . . 0 "[ . 1 . 2 ]"
169 . 1 109 LYS C 1 110 VAL N 1 110 VAL CA 1 110 VAL C 160.00 -40.00 -96.35 -95.20 -96.19 . . 0 "[ . 1 . 2 ]"
170 . 1 110 VAL C 1 111 LEU N 1 111 LEU CA 1 111 LEU C -180.00 -60.00 -121.56 -126.98 -113.69 . . 0 "[ . 1 . 2 ]"
171 . 1 111 LEU C 1 112 ILE N 1 112 ILE CA 1 112 ILE C -180.00 -60.00 -93.92 -97.03 -89.43 . . 0 "[ . 1 . 2 ]"
172 . 1 112 ILE C 1 113 ILE N 1 113 ILE CA 1 113 ILE C -180.00 -60.00 -80.80 -78.66 -79.69 . . 0 "[ . 1 . 2 ]"
173 . 1 113 ILE C 1 114 ILE N 1 114 ILE CA 1 114 ILE C -180.00 -60.00 -116.66 -126.29 -104.58 . . 0 "[ . 1 . 2 ]"
174 . 1 114 ILE C 1 115 THR N 1 115 THR CA 1 115 THR C -180.00 -60.00 -145.12 -146.19 -146.59 . . 0 "[ . 1 . 2 ]"
175 . 1 123 GLY C 1 124 ASN N 1 124 ASN CA 1 124 ASN C 160.00 -40.00 -148.74 -150.88 -151.06 . . 0 "[ . 1 . 2 ]"
176 . 1 125 ILE C 1 126 ASP N 1 126 ASP CA 1 126 ASP C -100.00 -20.00 -55.19 -57.93 -53.28 . . 0 "[ . 1 . 2 ]"
177 . 1 126 ASP C 1 127 ALA N 1 127 ALA CA 1 127 ALA C -100.00 -20.00 -45.23 -47.94 -43.36 . . 0 "[ . 1 . 2 ]"
178 . 1 128 ALA C 1 129 LYS N 1 129 LYS CA 1 129 LYS C -100.00 -20.00 -49.27 -50.94 -51.15 . . 0 "[ . 1 . 2 ]"
179 . 1 132 ILE C 1 133 ARG N 1 133 ARG CA 1 133 ARG C 160.00 -40.00 -75.01 -78.27 -69.18 . . 0 "[ . 1 . 2 ]"
180 . 1 133 ARG C 1 134 TYR N 1 134 TYR CA 1 134 TYR C -180.00 -60.00 -85.04 -88.05 -79.15 . . 0 "[ . 1 . 2 ]"
181 . 1 134 TYR C 1 135 ILE N 1 135 ILE CA 1 135 ILE C -180.00 -60.00 -137.31 -142.08 -130.34 . . 0 "[ . 1 . 2 ]"
182 . 1 135 ILE C 1 136 ILE N 1 136 ILE CA 1 136 ILE C -180.00 -60.00 -99.86 -98.99 -101.95 . . 0 "[ . 1 . 2 ]"
183 . 1 136 ILE C 1 137 GLY N 1 137 GLY CA 1 137 GLY C -180.00 -60.00 -96.27 -105.18 -89.69 . . 0 "[ . 1 . 2 ]"
184 . 1 137 GLY C 1 138 ILE N 1 138 ILE CA 1 138 ILE C 160.00 -40.00 -67.73 -68.18 -68.72 . . 0 "[ . 1 . 2 ]"
185 . 1 139 GLY C 1 140 LYS N 1 140 LYS CA 1 140 LYS C -120.00 100.00 -91.03 -97.63 -100.67 . . 0 "[ . 1 . 2 ]"
186 . 1 143 GLN C 1 144 THR N 1 144 THR CA 1 144 THR C 160.00 -40.00 -78.84 -84.60 -68.86 . . 0 "[ . 1 . 2 ]"
187 . 1 144 THR C 1 145 LYS N 1 145 LYS CA 1 145 LYS C -100.00 -20.00 -48.38 -56.38 -32.41 . . 0 "[ . 1 . 2 ]"
188 . 1 145 LYS C 1 146 GLU N 1 146 GLU CA 1 146 GLU C -100.00 -20.00 -53.05 -51.73 -52.36 . . 0 "[ . 1 . 2 ]"
189 . 1 146 GLU C 1 147 SER N 1 147 SER CA 1 147 SER C -100.00 -20.00 -69.57 -68.97 -69.92 . . 0 "[ . 1 . 2 ]"
190 . 1 147 SER C 1 148 GLN N 1 148 GLN CA 1 148 GLN C -100.00 -20.00 -49.65 -53.46 -40.61 . . 0 "[ . 1 . 2 ]"
191 . 1 148 GLN C 1 149 GLU N 1 149 GLU CA 1 149 GLU C -100.00 -20.00 -52.29 -57.59 -47.27 . . 0 "[ . 1 . 2 ]"
192 . 1 149 GLU C 1 150 THR N 1 150 THR CA 1 150 THR C -100.00 -20.00 -64.96 -77.82 -54.55 . . 0 "[ . 1 . 2 ]"
193 . 1 149 GLU C 1 150 THR N 1 150 THR CA 1 150 THR C -100.00 -20.00 -64.96 -77.82 -54.55 . . 0 "[ . 1 . 2 ]"
194 . 1 158 PRO C 1 159 ALA N 1 159 ALA CA 1 159 ALA C -100.00 -20.00 -56.07 -57.26 -57.59 . . 0 "[ . 1 . 2 ]"
195 . 1 159 ALA C 1 160 SER N 1 160 SER CA 1 160 SER C -100.00 -20.00 -56.48 -55.35 -55.57 . . 0 "[ . 1 . 2 ]"
196 . 1 162 PHE C 1 163 VAL N 1 163 VAL CA 1 163 VAL C 160.00 -40.00 -92.02 -97.89 -82.67 . . 0 "[ . 1 . 2 ]"
197 . 1 163 VAL C 1 164 LYS N 1 164 LYS CA 1 164 LYS C -180.00 -60.00 -121.85 -133.18 -104.28 . . 0 "[ . 1 . 2 ]"
198 . 1 164 LYS C 1 165 ILE N 1 165 ILE CA 1 165 ILE C -180.00 -60.00 -76.41 -87.66 -73.03 . . 0 "[ . 1 . 2 ]"
199 . 1 165 ILE C 1 166 LEU N 1 166 LEU CA 1 166 LEU C 160.00 -40.00 -101.68 -125.15 -126.84 . . 0 "[ . 1 . 2 ]"
200 . 1 167 ASP C 1 168 THR N 1 168 THR CA 1 168 THR C 160.00 -40.00 -142.51 -140.49 -141.94 . . 0 "[ . 1 . 2 ]"
201 . 1 169 PHE C 1 170 GLU N 1 170 GLU CA 1 170 GLU C -100.00 -20.00 -43.53 -42.53 -43.58 . . 0 "[ . 1 . 2 ]"
202 . 1 171 LYS C 1 172 LEU N 1 172 LEU CA 1 172 LEU C -100.00 -20.00 -52.70 -56.31 -48.17 . . 0 "[ . 1 . 2 ]"
203 . 1 174 ASP C 1 175 LEU N 1 175 LEU CA 1 175 LEU C -100.00 -20.00 -51.77 -56.34 -40.91 . . 0 "[ . 1 . 2 ]"
204 . 1 175 LEU C 1 176 PHE N 1 176 PHE CA 1 176 PHE C -100.00 -20.00 -46.37 -50.94 -34.38 . . 0 "[ . 1 . 2 ]"
205 . 1 176 PHE C 1 177 THR N 1 177 THR CA 1 177 THR C -100.00 -20.00 -56.40 -56.83 -57.08 . . 0 "[ . 1 . 2 ]"
206 . 1 177 THR C 1 178 GLU N 1 178 GLU CA 1 178 GLU C -100.00 -20.00 -61.65 -57.65 -58.76 . . 0 "[ . 1 . 2 ]"
207 . 1 178 GLU C 1 179 LEU N 1 179 LEU CA 1 179 LEU C -100.00 -20.00 -62.82 -66.93 -58.58 . . 0 "[ . 1 . 2 ]"
208 . 1 179 LEU C 1 180 GLN N 1 180 GLN CA 1 180 GLN C -100.00 -20.00 -55.52 -60.22 -48.21 . . 0 "[ . 1 . 2 ]"
209 . 1 180 GLN C 1 181 LYS N 1 181 LYS CA 1 181 LYS C -100.00 -20.00 -54.51 -66.61 -44.91 . . 0 "[ . 1 . 2 ]"
210 . 1 181 LYS C 1 182 LYS N 1 182 LYS CA 1 182 LYS C -100.00 -20.00 -63.59 -59.35 -61.52 . . 0 "[ . 1 . 2 ]"
211 . 1 182 LYS C 1 183 ILE N 1 183 ILE CA 1 183 ILE C -100.00 -20.00 -53.85 -59.15 -48.90 . . 0 "[ . 1 . 2 ]"
212 . 1 7 VAL N 1 7 VAL CA 1 7 VAL CB 1 7 VAL CG1 150.00 -150.00 178.11 171.92 -171.68 . . 0 "[ . 1 . 2 ]"
213 . 1 10 VAL N 1 10 VAL CA 1 10 VAL CB 1 10 VAL CG1 150.00 -150.00 -179.20 -178.85 -178.88 . . 0 "[ . 1 . 2 ]"
214 . 1 23 GLU N 1 23 GLU CA 1 23 GLU CB 1 23 GLU CG 150.00 -30.00 -54.14 -49.31 -53.45 . . 0 "[ . 1 . 2 ]"
215 . 1 27 ILE N 1 27 ILE CA 1 27 ILE CB 1 27 ILE CG1 -90.00 -30.00 -58.73 -75.57 -51.13 . . 0 "[ . 1 . 2 ]"
216 . 1 34 VAL N 1 34 VAL CA 1 34 VAL CB 1 34 VAL CG1 150.00 -150.00 178.24 175.17 -177.88 . . 0 "[ . 1 . 2 ]"
217 . 1 41 THR N 1 41 THR CA 1 41 THR CB 1 41 THR OG1 -90.00 -30.00 -41.03 -54.41 -29.35 0.65 12 0 "[ . 1 . 2 ]"
218 . 1 52 THR N 1 52 THR CA 1 52 THR CB 1 52 THR OG1 -90.00 -30.00 -58.22 -61.46 -49.81 . . 0 "[ . 1 . 2 ]"
219 . 1 55 LYS N 1 55 LYS CA 1 55 LYS CB 1 55 LYS CG 150.00 -150.00 179.10 178.55 178.10 . . 0 "[ . 1 . 2 ]"
220 . 1 62 ASP N 1 62 ASP CA 1 62 ASP CB 1 62 ASP CG -90.00 -30.00 -63.00 -65.64 -60.95 . . 0 "[ . 1 . 2 ]"
221 . 1 64 VAL N 1 64 VAL CA 1 64 VAL CB 1 64 VAL CG1 150.00 -150.00 164.12 167.37 164.95 . . 0 "[ . 1 . 2 ]"
222 . 1 66 TRP N 1 66 TRP CA 1 66 TRP CB 1 66 TRP CG -90.00 -30.00 -53.80 -64.15 -51.22 . . 0 "[ . 1 . 2 ]"
223 . 1 72 LEU N 1 72 LEU CA 1 72 LEU CB 1 72 LEU CG -90.00 -30.00 -68.04 -71.49 -59.62 . . 0 "[ . 1 . 2 ]"
224 . 1 73 LEU N 1 73 LEU CA 1 73 LEU CB 1 73 LEU CG -90.00 -30.00 -68.38 -89.88 -63.99 . . 0 "[ . 1 . 2 ]"
225 . 1 76 VAL N 1 76 VAL CA 1 76 VAL CB 1 76 VAL CG1 150.00 -150.00 179.64 178.74 176.74 . . 0 "[ . 1 . 2 ]"
226 . 1 81 LEU N 1 81 LEU CA 1 81 LEU CB 1 81 LEU CG -90.00 -30.00 -52.18 -58.58 -47.33 . . 0 "[ . 1 . 2 ]"
227 . 1 82 LEU N 1 82 LEU CA 1 82 LEU CB 1 82 LEU CG 150.00 -30.00 -51.84 -51.15 -51.44 . . 0 "[ . 1 . 2 ]"
228 . 1 83 THR N 1 83 THR CA 1 83 THR CB 1 83 THR OG1 -90.00 -30.00 -54.46 -48.60 -50.15 . . 0 "[ . 1 . 2 ]"
229 . 1 85 THR N 1 85 THR CA 1 85 THR CB 1 85 THR OG1 -90.00 -30.00 -31.12 -29.02 -29.36 1.48 6 0 "[ . 1 . 2 ]"
230 . 1 86 PHE N 1 86 PHE CA 1 86 PHE CB 1 86 PHE CG -90.00 -30.00 -71.30 -76.77 -78.10 . . 0 "[ . 1 . 2 ]"
231 . 1 89 ILE N 1 89 ILE CA 1 89 ILE CB 1 89 ILE CG1 -90.00 -30.00 -73.60 -73.56 -73.73 . . 0 "[ . 1 . 2 ]"
232 . 1 92 VAL N 1 92 VAL CA 1 92 VAL CB 1 92 VAL CG1 150.00 -150.00 164.84 164.99 164.71 . . 0 "[ . 1 . 2 ]"
233 . 1 94 THR N 1 94 THR CA 1 94 THR CB 1 94 THR OG1 30.00 90.00 51.42 48.36 56.11 . . 0 "[ . 1 . 2 ]"
234 . 1 95 GLU N 1 95 GLU CA 1 95 GLU CB 1 95 GLU CG -90.00 -30.00 -51.87 -56.86 -47.18 . . 0 "[ . 1 . 2 ]"
235 . 1 96 VAL N 1 96 VAL CA 1 96 VAL CB 1 96 VAL CG1 150.00 -150.00 -178.48 -178.90 -179.66 . . 0 "[ . 1 . 2 ]"
236 . 1 108 THR N 1 108 THR CA 1 108 THR CB 1 108 THR OG1 -90.00 -30.00 -45.10 -40.30 -42.16 . . 0 "[ . 1 . 2 ]"
237 . 1 110 VAL N 1 110 VAL CA 1 110 VAL CB 1 110 VAL CG1 150.00 -150.00 -177.81 -179.80 -176.36 . . 0 "[ . 1 . 2 ]"
238 . 1 112 ILE N 1 112 ILE CA 1 112 ILE CB 1 112 ILE CG1 -90.00 -30.00 -54.35 -55.48 -52.24 . . 0 "[ . 1 . 2 ]"
239 . 1 113 ILE N 1 113 ILE CA 1 113 ILE CB 1 113 ILE CG1 -90.00 -30.00 -56.80 -61.28 -51.86 . . 0 "[ . 1 . 2 ]"
240 . 1 115 THR N 1 115 THR CA 1 115 THR CB 1 115 THR OG1 150.00 -150.00 178.83 -179.85 179.47 . . 0 "[ . 1 . 2 ]"
241 . 1 116 ASP N 1 116 ASP CA 1 116 ASP CB 1 116 ASP CG 30.00 90.00 76.24 75.65 74.32 0.01 6 0 "[ . 1 . 2 ]"
242 . 1 120 THR N 1 120 THR CA 1 120 THR CB 1 120 THR OG1 30.00 90.00 49.75 46.53 53.25 . . 0 "[ . 1 . 2 ]"
243 . 1 125 ILE N 1 125 ILE CA 1 125 ILE CB 1 125 ILE CG1 30.00 90.00 62.33 61.04 64.59 . . 0 "[ . 1 . 2 ]"
244 . 1 131 ILE N 1 131 ILE CA 1 131 ILE CB 1 131 ILE CG1 -90.00 -30.00 -57.83 -79.87 -46.97 . . 0 "[ . 1 . 2 ]"
245 . 1 132 ILE N 1 132 ILE CA 1 132 ILE CB 1 132 ILE CG1 -90.00 -30.00 -45.00 -46.48 -43.10 . . 0 "[ . 1 . 2 ]"
246 . 1 136 ILE N 1 136 ILE CA 1 136 ILE CB 1 136 ILE CG1 -90.00 -30.00 -55.77 -51.87 -52.79 . . 0 "[ . 1 . 2 ]"
247 . 1 138 ILE N 1 138 ILE CA 1 138 ILE CB 1 138 ILE CG1 -90.00 -30.00 -41.86 -59.49 -36.59 . . 0 "[ . 1 . 2 ]"
248 . 1 142 PHE N 1 142 PHE CA 1 142 PHE CB 1 142 PHE CG -90.00 -30.00 -59.90 -56.53 -57.14 . . 0 "[ . 1 . 2 ]"
249 . 1 144 THR N 1 144 THR CA 1 144 THR CB 1 144 THR OG1 30.00 90.00 42.70 28.73 28.28 2.39 1 0 "[ . 1 . 2 ]"
250 . 1 145 LYS N 1 145 LYS CA 1 145 LYS CB 1 145 LYS CG 150.00 -30.00 -170.21 -171.74 -175.60 . . 0 "[ . 1 . 2 ]"
251 . 1 152 HIS N 1 152 HIS CA 1 152 HIS CB 1 152 HIS CG -90.00 -30.00 -57.06 -58.91 -62.14 . . 0 "[ . 1 . 2 ]"
252 . 1 163 VAL N 1 163 VAL CA 1 163 VAL CB 1 163 VAL CG1 150.00 -150.00 -179.97 -179.88 179.58 . . 0 "[ . 1 . 2 ]"
253 . 1 165 ILE N 1 165 ILE CA 1 165 ILE CB 1 165 ILE CG1 -90.00 -30.00 -50.34 -53.80 -46.20 . . 0 "[ . 1 . 2 ]"
254 . 1 168 THR N 1 168 THR CA 1 168 THR CB 1 168 THR OG1 30.00 90.00 41.81 30.61 46.82 . . 0 "[ . 1 . 2 ]"
255 . 1 169 PHE N 1 169 PHE CA 1 169 PHE CB 1 169 PHE CG -90.00 -30.00 -54.16 -55.23 -55.46 . . 0 "[ . 1 . 2 ]"
256 . 1 172 LEU N 1 172 LEU CA 1 172 LEU CB 1 172 LEU CG 150.00 -30.00 -74.04 -78.08 -67.62 . . 0 "[ . 1 . 2 ]"
257 . 1 176 PHE N 1 176 PHE CA 1 176 PHE CB 1 176 PHE CG 150.00 -30.00 158.06 149.50 172.39 0.50 19 0 "[ . 1 . 2 ]"
258 . 1 177 THR N 1 177 THR CA 1 177 THR CB 1 177 THR OG1 -90.00 -30.00 -46.49 -49.20 -49.79 . . 0 "[ . 1 . 2 ]"
259 . 1 183 ILE N 1 183 ILE CA 1 183 ILE CB 1 183 ILE CG1 -90.00 -30.00 -65.62 -63.06 -65.37 . . 0 "[ . 1 . 2 ]"
260 . 1 186 ILE N 1 186 ILE CA 1 186 ILE CB 1 186 ILE CG1 -90.00 -30.00 -55.91 -68.36 -45.34 . . 0 "[ . 1 . 2 ]"
261 . 1 186 ILE N 1 186 ILE CA 1 186 ILE CB 1 186 ILE CG1 -90.00 -30.00 -55.91 -68.36 -45.34 . . 0 "[ . 1 . 2 ]"
262 . 1 8 ASP N 1 8 ASP CA 1 8 ASP CB 1 8 ASP CG -90.00 -30.00 -81.62 -84.87 -90.32 0.32 1 0 "[ . 1 . 2 ]"
263 . 1 9 LEU N 1 9 LEU CA 1 9 LEU CB 1 9 LEU CG 150.00 -150.00 -158.39 -159.22 -159.26 . . 0 "[ . 1 . 2 ]"
264 . 1 12 LEU N 1 12 LEU CA 1 12 LEU CB 1 12 LEU CG 150.00 -150.00 173.89 175.49 175.09 . . 0 "[ . 1 . 2 ]"
265 . 1 19 LEU N 1 19 LEU CA 1 19 LEU CB 1 19 LEU CG -90.00 -30.00 -80.65 -84.80 -66.08 . . 0 "[ . 1 . 2 ]"
266 . 1 24 PHE N 1 24 PHE CA 1 24 PHE CB 1 24 PHE CG 150.00 -150.00 -163.69 -163.30 -166.71 . . 0 "[ . 1 . 2 ]"
267 . 1 28 LEU N 1 28 LEU CA 1 28 LEU CB 1 28 LEU CG -90.00 -30.00 -53.90 -53.53 -53.77 . . 0 "[ . 1 . 2 ]"
268 . 1 35 MET N 1 35 MET CA 1 35 MET CB 1 35 MET CG -90.00 -30.00 -66.53 -63.31 -64.83 . . 0 "[ . 1 . 2 ]"
269 . 1 43 TYR N 1 43 TYR CA 1 43 TYR CB 1 43 TYR CG -90.00 -30.00 -71.94 -69.23 -71.40 . . 0 "[ . 1 . 2 ]"
270 . 1 45 PHE N 1 45 PHE CA 1 45 PHE CB 1 45 PHE CG -90.00 -30.00 -54.02 -51.40 -52.46 . . 0 "[ . 1 . 2 ]"
271 . 1 50 PHE N 1 50 PHE CA 1 50 PHE CB 1 50 PHE CG 30.00 90.00 84.46 85.16 84.89 3.31 10 0 "[ . 1 . 2 ]"
272 . 1 54 TYR N 1 54 TYR CA 1 54 TYR CB 1 54 TYR CG 30.00 90.00 38.31 29.80 42.69 0.20 9 0 "[ . 1 . 2 ]"
273 . 1 78 HIS N 1 78 HIS CA 1 78 HIS CB 1 78 HIS CG 150.00 -150.00 -162.76 -164.03 -164.65 . . 0 "[ . 1 . 2 ]"
274 . 1 79 MET N 1 79 MET CA 1 79 MET CB 1 79 MET CG -90.00 -30.00 -78.87 -88.34 -69.58 . . 0 "[ . 1 . 2 ]"
275 . 1 84 ASN N 1 84 ASN CA 1 84 ASN CB 1 84 ASN CG 150.00 -150.00 -177.64 -179.10 -179.87 . . 0 "[ . 1 . 2 ]"
276 . 1 91 TYR N 1 91 TYR CA 1 91 TYR CB 1 91 TYR CG 150.00 -150.00 173.02 171.54 175.27 . . 0 "[ . 1 . 2 ]"
277 . 1 101 LEU N 1 101 LEU CA 1 101 LEU CB 1 101 LEU CG -90.00 -30.00 -55.59 -55.90 -56.82 . . 0 "[ . 1 . 2 ]"
278 . 1 109 LYS N 1 109 LYS CA 1 109 LYS CB 1 109 LYS CG -90.00 -30.00 -60.46 -62.04 -58.67 . . 0 "[ . 1 . 2 ]"
279 . 1 111 LEU N 1 111 LEU CA 1 111 LEU CB 1 111 LEU CG 150.00 -150.00 173.59 -164.38 172.31 . . 0 "[ . 1 . 2 ]"
280 . 1 133 ARG N 1 133 ARG CA 1 133 ARG CB 1 133 ARG CG -90.00 -30.00 -71.13 -70.91 -70.98 . . 0 "[ . 1 . 2 ]"
281 . 1 134 TYR N 1 134 TYR CA 1 134 TYR CB 1 134 TYR CG 150.00 -150.00 -159.56 -163.18 -156.32 . . 0 "[ . 1 . 2 ]"
282 . 1 151 LEU N 1 151 LEU CA 1 151 LEU CB 1 151 LEU CG -90.00 -30.00 -59.38 -58.54 -59.38 . . 0 "[ . 1 . 2 ]"
283 . 1 157 LYS N 1 157 LYS CA 1 157 LYS CB 1 157 LYS CG -90.00 -30.00 -46.18 -50.02 -41.13 . . 0 "[ . 1 . 2 ]"
284 . 1 161 GLU N 1 161 GLU CA 1 161 GLU CB 1 161 GLU CG -90.00 -30.00 -63.15 -67.56 -58.05 . . 0 "[ . 1 . 2 ]"
285 . 1 174 ASP N 1 174 ASP CA 1 174 ASP CB 1 174 ASP CG 150.00 -150.00 176.63 175.67 175.66 . . 0 "[ . 1 . 2 ]"
286 . 1 175 LEU N 1 175 LEU CA 1 175 LEU CB 1 175 LEU CG 150.00 -150.00 174.57 175.77 175.32 . . 0 "[ . 1 . 2 ]"
287 . 1 175 LEU N 1 175 LEU CA 1 175 LEU CB 1 175 LEU CG 150.00 -150.00 174.57 175.77 175.32 . . 0 "[ . 1 . 2 ]"
288 . 1 118 GLU N 1 118 GLU CA 1 118 GLU CB 1 118 GLU CG -90.00 -30.00 -60.87 -76.57 -46.01 . . 0 "[ . 1 . 2 ]"
289 . 1 118 GLU N 1 118 GLU CA 1 118 GLU CB 1 118 GLU CG -90.00 -30.00 -60.87 -76.57 -46.01 . . 0 "[ . 1 . 2 ]"
290 . 1 118 GLU N 1 118 GLU CA 1 118 GLU CB 1 118 GLU CG -90.00 -30.00 -60.87 -76.57 -46.01 . . 0 "[ . 1 . 2 ]"
291 . 1 118 GLU N 1 118 GLU CA 1 118 GLU CB 1 118 GLU CG -90.00 -30.00 -60.87 -76.57 -46.01 . . 0 "[ . 1 . 2 ]"
stop_
save_
save_distance_constraint_statistics_2
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 2
_TA_constraint_stats_list.Viol_count 2
_TA_constraint_stats_list.Viol_total 18.61
_TA_constraint_stats_list.Viol_max 0.83
_TA_constraint_stats_list.Viol_rms 0.13
_TA_constraint_stats_list.Viol_average_all_restraints 0.02
_TA_constraint_stats_list.Viol_average_violations_only 0.42
_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 . 1 158 PRO CA 1 158 PRO N 1 157 LYS C 1 157 LYS CA -10.00 10.00 1.64 -1.88 4.20 . . 0 "[ . 1 . 2 ]"
2 . 1 2 ALA CA 1 2 ALA N 1 1 MET C 1 1 MET CA 170.00 -170.00 178.26 176.52 172.82 0.83 20 0 "[ . 1 . 2 ]"
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