NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
481827 |
1hry   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1hry
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 241
_TA_constraint_stats_list.Viol_count 22
_TA_constraint_stats_list.Viol_total 38.13
_TA_constraint_stats_list.Viol_max 7.35
_TA_constraint_stats_list.Viol_rms 0.72
_TA_constraint_stats_list.Viol_average_all_restraints 0.16
_TA_constraint_stats_list.Viol_average_violations_only 1.73
_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 . 3 3 ASP C 3 4 ARG N 3 4 ARG CA 3 4 ARG C -85.00 -65.00 -76.94 -76.94 -76.94 . . 0 "[ ]"
2 . 3 4 ARG C 3 5 VAL N 3 5 VAL CA 3 5 VAL C -98.00 -78.00 -88.52 -88.52 -88.52 . . 0 "[ ]"
3 . 3 5 VAL C 3 6 LYS N 3 6 LYS CA 3 6 LYS C -90.00 -70.00 -72.61 -72.61 -72.61 . . 0 "[ ]"
4 . 3 6 LYS C 3 7 ARG N 3 7 ARG CA 3 7 ARG C -150.00 -90.00 -142.53 -142.53 -142.53 . . 0 "[ ]"
5 . 3 7 ARG C 3 8 PRO N 3 8 PRO CA 3 8 PRO C -77.00 -37.00 -66.76 -66.76 -66.76 . . 0 "[ ]"
6 . 3 8 PRO C 3 9 MET N 3 9 MET CA 3 9 MET C -75.00 -55.00 -64.86 -64.86 -64.86 . . 0 "[ ]"
7 . 3 9 MET C 3 10 ASN N 3 10 ASN CA 3 10 ASN C -120.00 -60.00 -86.50 -86.50 -86.50 . . 0 "[ ]"
8 . 3 10 ASN C 3 11 ALA N 3 11 ALA CA 3 11 ALA C -50.00 -30.00 -44.03 -44.03 -44.03 . . 0 "[ ]"
9 . 3 11 ALA C 3 12 PHE N 3 12 PHE CA 3 12 PHE C -90.00 -70.00 -78.60 -78.60 -78.60 . . 0 "[ ]"
10 . 3 12 PHE C 3 13 ILE N 3 13 ILE CA 3 13 ILE C -75.00 -55.00 -63.13 -63.13 -63.13 . . 0 "[ ]"
11 . 3 13 ILE C 3 14 VAL N 3 14 VAL CA 3 14 VAL C -63.00 -43.00 -52.07 -52.07 -52.07 . . 0 "[ ]"
12 . 3 14 VAL C 3 15 TRP N 3 15 TRP CA 3 15 TRP C -65.00 -45.00 -52.47 -52.47 -52.47 . . 0 "[ ]"
13 . 3 15 TRP C 3 16 SER N 3 16 SER CA 3 16 SER C -65.00 -25.00 -39.51 -39.51 -39.51 . . 0 "[ ]"
14 . 3 16 SER C 3 17 ARG N 3 17 ARG CA 3 17 ARG C -50.00 -30.00 -41.07 -41.07 -41.07 . . 0 "[ ]"
15 . 3 17 ARG C 3 18 ASP N 3 18 ASP CA 3 18 ASP C -83.00 -63.00 -77.53 -77.53 -77.53 . . 0 "[ ]"
16 . 3 18 ASP C 3 19 GLN N 3 19 GLN CA 3 19 GLN C -73.00 -53.00 -51.01 -51.01 -51.01 1.99 1 0 "[ ]"
17 . 3 19 GLN C 3 20 ARG N 3 20 ARG CA 3 20 ARG C -58.00 -38.00 -58.50 -58.50 -58.50 0.50 1 0 "[ ]"
18 . 3 20 ARG C 3 21 ARG N 3 21 ARG CA 3 21 ARG C -73.00 -53.00 -52.15 -52.15 -52.15 0.85 1 0 "[ ]"
19 . 3 21 ARG C 3 22 LYS N 3 22 LYS CA 3 22 LYS C -78.00 -58.00 -64.28 -64.28 -64.28 . . 0 "[ ]"
20 . 3 22 LYS C 3 23 MET N 3 23 MET CA 3 23 MET C -73.00 -53.00 -62.98 -62.98 -62.98 . . 0 "[ ]"
21 . 3 23 MET C 3 24 ALA N 3 24 ALA CA 3 24 ALA C -80.00 -60.00 -72.27 -72.27 -72.27 . . 0 "[ ]"
22 . 3 24 ALA C 3 25 LEU N 3 25 LEU CA 3 25 LEU C -77.00 -57.00 -66.10 -66.10 -66.10 . . 0 "[ ]"
23 . 3 25 LEU C 3 26 GLU N 3 26 GLU CA 3 26 GLU C -88.00 -68.00 -80.99 -80.99 -80.99 . . 0 "[ ]"
24 . 3 26 GLU C 3 27 ASN N 3 27 ASN CA 3 27 ASN C -140.00 -100.00 -136.66 -136.66 -136.66 . . 0 "[ ]"
25 . 3 27 ASN C 3 28 PRO N 3 28 PRO CA 3 28 PRO C -87.00 -27.00 -67.13 -67.13 -67.13 . . 0 "[ ]"
26 . 3 28 PRO C 3 29 ARG N 3 29 ARG CA 3 29 ARG C -135.00 -105.00 -124.03 -124.03 -124.03 . . 0 "[ ]"
27 . 3 29 ARG C 3 30 MET N 3 30 MET CA 3 30 MET C -88.00 -68.00 -81.12 -81.12 -81.12 . . 0 "[ ]"
28 . 3 30 MET C 3 31 ARG N 3 31 ARG CA 3 31 ARG C -85.00 -65.00 -64.61 -64.61 -64.61 0.39 1 0 "[ ]"
29 . 3 32 ASN C 3 33 SER N 3 33 SER CA 3 33 SER C -120.00 -60.00 -91.61 -91.61 -91.61 . . 0 "[ ]"
30 . 3 33 SER C 3 34 GLU N 3 34 GLU CA 3 34 GLU C -95.00 -75.00 -80.38 -80.38 -80.38 . . 0 "[ ]"
31 . 3 34 GLU C 3 35 ILE N 3 35 ILE CA 3 35 ILE C -60.00 -40.00 -48.78 -48.78 -48.78 . . 0 "[ ]"
32 . 3 35 ILE C 3 36 SER N 3 36 SER CA 3 36 SER C -90.00 -50.00 -80.89 -80.89 -80.89 . . 0 "[ ]"
33 . 3 36 SER C 3 37 LYS N 3 37 LYS CA 3 37 LYS C -73.00 -53.00 -65.42 -65.42 -65.42 . . 0 "[ ]"
34 . 3 37 LYS C 3 38 GLN N 3 38 GLN CA 3 38 GLN C -78.00 -58.00 -66.50 -66.50 -66.50 . . 0 "[ ]"
35 . 3 38 GLN C 3 39 LEU N 3 39 LEU CA 3 39 LEU C -70.00 -50.00 -58.66 -58.66 -58.66 . . 0 "[ ]"
36 . 3 39 LEU C 3 40 GLY N 3 40 GLY CA 3 40 GLY C -68.00 -48.00 -53.89 -53.89 -53.89 . . 0 "[ ]"
37 . 3 40 GLY C 3 41 TYR N 3 41 TYR CA 3 41 TYR C -70.00 -50.00 -62.10 -62.10 -62.10 . . 0 "[ ]"
38 . 3 41 TYR C 3 42 GLN N 3 42 GLN CA 3 42 GLN C -75.00 -55.00 -63.07 -63.07 -63.07 . . 0 "[ ]"
39 . 3 42 GLN C 3 43 TRP N 3 43 TRP CA 3 43 TRP C -90.00 -50.00 -62.28 -62.28 -62.28 . . 0 "[ ]"
40 . 3 43 TRP C 3 44 LYS N 3 44 LYS CA 3 44 LYS C -75.00 -55.00 -67.99 -67.99 -67.99 . . 0 "[ ]"
41 . 3 44 LYS C 3 45 MET N 3 45 MET CA 3 45 MET C -158.00 -138.00 -146.10 -146.10 -146.10 . . 0 "[ ]"
42 . 3 45 MET C 3 46 LEU N 3 46 LEU CA 3 46 LEU C -85.00 -45.00 -61.89 -61.89 -61.89 . . 0 "[ ]"
43 . 3 46 LEU C 3 47 THR N 3 47 THR CA 3 47 THR C -85.00 -65.00 -82.39 -82.39 -82.39 . . 0 "[ ]"
44 . 3 47 THR C 3 48 GLU N 3 48 GLU CA 3 48 GLU C -70.00 -30.00 -58.99 -58.99 -58.99 . . 0 "[ ]"
45 . 3 48 GLU C 3 49 ALA N 3 49 ALA CA 3 49 ALA C -73.00 -53.00 -59.40 -59.40 -59.40 . . 0 "[ ]"
46 . 3 49 ALA C 3 50 GLU N 3 50 GLU CA 3 50 GLU C -110.00 -70.00 -102.24 -102.24 -102.24 . . 0 "[ ]"
47 . 3 50 GLU C 3 51 LYS N 3 51 LYS CA 3 51 LYS C -85.00 -65.00 -69.30 -69.30 -69.30 . . 0 "[ ]"
48 . 3 51 LYS C 3 52 TRP N 3 52 TRP CA 3 52 TRP C -53.00 -33.00 -37.34 -37.34 -37.34 . . 0 "[ ]"
49 . 3 52 TRP C 3 53 PRO N 3 53 PRO CA 3 53 PRO C -87.00 -27.00 -42.15 -42.15 -42.15 . . 0 "[ ]"
50 . 3 53 PRO C 3 54 PHE N 3 54 PHE CA 3 54 PHE C -95.00 -55.00 -79.18 -79.18 -79.18 . . 0 "[ ]"
51 . 3 54 PHE C 3 55 PHE N 3 55 PHE CA 3 55 PHE C -90.00 -60.00 -63.40 -63.40 -63.40 . . 0 "[ ]"
52 . 3 55 PHE C 3 56 GLN N 3 56 GLN CA 3 56 GLN C -65.00 -45.00 -53.61 -53.61 -53.61 . . 0 "[ ]"
53 . 3 56 GLN C 3 57 GLU N 3 57 GLU CA 3 57 GLU C -73.00 -53.00 -67.51 -67.51 -67.51 . . 0 "[ ]"
54 . 3 57 GLU C 3 58 ALA N 3 58 ALA CA 3 58 ALA C -65.00 -45.00 -49.02 -49.02 -49.02 . . 0 "[ ]"
55 . 3 58 ALA C 3 59 GLN N 3 59 GLN CA 3 59 GLN C -80.00 -60.00 -65.03 -65.03 -65.03 . . 0 "[ ]"
56 . 3 59 GLN C 3 60 LYS N 3 60 LYS CA 3 60 LYS C -73.00 -53.00 -66.94 -66.94 -66.94 . . 0 "[ ]"
57 . 3 60 LYS C 3 61 LEU N 3 61 LEU CA 3 61 LEU C -60.00 -20.00 -46.04 -46.04 -46.04 . . 0 "[ ]"
58 . 3 61 LEU C 3 62 GLN N 3 62 GLN CA 3 62 GLN C -73.00 -53.00 -61.25 -61.25 -61.25 . . 0 "[ ]"
59 . 3 62 GLN C 3 63 ALA N 3 63 ALA CA 3 63 ALA C -70.00 -50.00 -50.11 -50.11 -50.11 . . 0 "[ ]"
60 . 3 63 ALA C 3 64 MET N 3 64 MET CA 3 64 MET C -75.00 -55.00 -64.22 -64.22 -64.22 . . 0 "[ ]"
61 . 3 64 MET C 3 65 HIS N 3 65 HIS CA 3 65 HIS C -73.00 -53.00 -55.04 -55.04 -55.04 . . 0 "[ ]"
62 . 3 65 HIS C 3 66 ARG N 3 66 ARG CA 3 66 ARG C -75.00 -55.00 -61.16 -61.16 -61.16 . . 0 "[ ]"
63 . 3 66 ARG C 3 67 GLU N 3 67 GLU CA 3 67 GLU C -85.00 -65.00 -66.84 -66.84 -66.84 . . 0 "[ ]"
64 . 3 67 GLU C 3 68 LYS N 3 68 LYS CA 3 68 LYS C -93.00 -73.00 -86.98 -86.98 -86.98 . . 0 "[ ]"
65 . 3 68 LYS C 3 69 TYR N 3 69 TYR CA 3 69 TYR C -150.00 -110.00 -131.73 -131.73 -131.73 . . 0 "[ ]"
66 . 3 69 TYR C 3 70 PRO N 3 70 PRO CA 3 70 PRO C -90.00 -30.00 -50.34 -50.34 -50.34 . . 0 "[ ]"
67 . 3 70 PRO C 3 71 ASN N 3 71 ASN CA 3 71 ASN C -120.00 0.00 -84.68 -84.68 -84.68 . . 0 "[ ]"
68 . 3 71 ASN C 3 72 TYR N 3 72 TYR CA 3 72 TYR C -90.00 -30.00 -70.86 -70.86 -70.86 . . 0 "[ ]"
69 . 3 72 TYR C 3 73 LYS N 3 73 LYS CA 3 73 LYS C -140.00 -100.00 -122.64 -122.64 -122.64 . . 0 "[ ]"
70 . 3 73 LYS C 3 74 TYR N 3 74 TYR CA 3 74 TYR C -80.00 -40.00 -59.90 -59.90 -59.90 . . 0 "[ ]"
71 . 3 74 TYR C 3 75 ARG N 3 75 ARG CA 3 75 ARG C -140.00 -100.00 -140.97 -140.97 -140.97 0.97 1 0 "[ ]"
72 . 3 3 ASP N 3 3 ASP CA 3 3 ASP C 3 4 ARG N -120.00 -80.00 -101.27 -101.27 -101.27 . . 0 "[ ]"
73 . 3 4 ARG N 3 4 ARG CA 3 4 ARG C 3 5 VAL N 60.00 140.00 133.64 133.64 133.64 . . 0 "[ ]"
74 . 3 5 VAL N 3 5 VAL CA 3 5 VAL C 3 6 LYS N 130.00 -170.00 156.28 156.28 156.28 . . 0 "[ ]"
75 . 3 6 LYS N 3 6 LYS CA 3 6 LYS C 3 7 ARG N 120.00 180.00 151.83 151.83 151.83 . . 0 "[ ]"
76 . 3 69 TYR N 3 69 TYR CA 3 69 TYR C 3 70 PRO N 40.00 100.00 54.92 54.92 54.92 . . 0 "[ ]"
77 . 3 70 PRO N 3 70 PRO CA 3 70 PRO C 3 71 ASN N -90.00 -30.00 -70.10 -70.10 -70.10 . . 0 "[ ]"
78 . 3 71 ASN N 3 71 ASN CA 3 71 ASN C 3 72 TYR N -30.00 30.00 -9.98 -9.98 -9.98 . . 0 "[ ]"
79 . 3 72 TYR N 3 72 TYR CA 3 72 TYR C 3 73 LYS N 60.00 120.00 121.28 121.28 121.28 1.28 1 0 "[ ]"
80 . 3 73 LYS N 3 73 LYS CA 3 73 LYS C 3 74 TYR N 125.00 -165.00 169.50 169.50 169.50 . . 0 "[ ]"
81 . 3 74 TYR N 3 74 TYR CA 3 74 TYR C 3 75 ARG N 110.00 180.00 165.68 165.68 165.68 . . 0 "[ ]"
82 . 3 4 ARG N 3 4 ARG CA 3 4 ARG CB 3 4 ARG CG -80.00 -40.00 -59.41 -59.41 -59.41 . . 0 "[ ]"
83 . 3 5 VAL N 3 5 VAL CA 3 5 VAL CB 3 5 VAL CG1 160.00 -160.00 -176.01 -176.01 -176.01 . . 0 "[ ]"
84 . 3 7 ARG N 3 7 ARG CA 3 7 ARG CB 3 7 ARG CG 40.00 80.00 48.85 48.85 48.85 . . 0 "[ ]"
85 . 3 9 MET N 3 9 MET CA 3 9 MET CB 3 9 MET CG -80.00 -40.00 -55.55 -55.55 -55.55 . . 0 "[ ]"
86 . 3 10 ASN N 3 10 ASN CA 3 10 ASN CB 3 10 ASN CG -80.00 -40.00 -44.95 -44.95 -44.95 . . 0 "[ ]"
87 . 3 12 PHE N 3 12 PHE CA 3 12 PHE CB 3 12 PHE CG 160.00 -160.00 169.37 169.37 169.37 . . 0 "[ ]"
88 . 3 13 ILE N 3 13 ILE CA 3 13 ILE CB 3 13 ILE CG1 -80.00 -40.00 -79.70 -79.70 -79.70 . . 0 "[ ]"
89 . 3 14 VAL N 3 14 VAL CA 3 14 VAL CB 3 14 VAL CG1 160.00 -160.00 172.70 172.70 172.70 . . 0 "[ ]"
90 . 3 15 TRP N 3 15 TRP CA 3 15 TRP CB 3 15 TRP CG -80.00 -40.00 -80.44 -80.44 -80.44 0.44 1 0 "[ ]"
91 . 3 16 SER N 3 16 SER CA 3 16 SER CB 3 16 SER OG 160.00 -160.00 -159.57 -159.57 -159.57 0.43 1 0 "[ ]"
92 . 3 17 ARG N 3 17 ARG CA 3 17 ARG CB 3 17 ARG CG -80.00 -40.00 -53.64 -53.64 -53.64 . . 0 "[ ]"
93 . 3 18 ASP N 3 18 ASP CA 3 18 ASP CB 3 18 ASP CG -80.00 -40.00 -54.09 -54.09 -54.09 . . 0 "[ ]"
94 . 3 19 GLN N 3 19 GLN CA 3 19 GLN CB 3 19 GLN CG 160.00 -160.00 -178.82 -178.82 -178.82 . . 0 "[ ]"
95 . 3 21 ARG N 3 21 ARG CA 3 21 ARG CB 3 21 ARG CG 160.00 -160.00 166.65 166.65 166.65 . . 0 "[ ]"
96 . 3 22 LYS N 3 22 LYS CA 3 22 LYS CB 3 22 LYS CG 160.00 -160.00 -177.28 -177.28 -177.28 . . 0 "[ ]"
97 . 3 23 MET N 3 23 MET CA 3 23 MET CB 3 23 MET CG 160.00 -160.00 -163.08 -163.08 -163.08 . . 0 "[ ]"
98 . 3 25 LEU N 3 25 LEU CA 3 25 LEU CB 3 25 LEU CG -80.00 -40.00 -66.08 -66.08 -66.08 . . 0 "[ ]"
99 . 3 26 GLU N 3 26 GLU CA 3 26 GLU CB 3 26 GLU CG -80.00 -40.00 -70.45 -70.45 -70.45 . . 0 "[ ]"
100 . 3 27 ASN N 3 27 ASN CA 3 27 ASN CB 3 27 ASN CG -80.00 -40.00 -66.62 -66.62 -66.62 . . 0 "[ ]"
101 . 3 29 ARG N 3 29 ARG CA 3 29 ARG CB 3 29 ARG CG -90.00 -30.00 -60.13 -60.13 -60.13 . . 0 "[ ]"
102 . 3 30 MET N 3 30 MET CA 3 30 MET CB 3 30 MET CG -80.00 -40.00 -60.83 -60.83 -60.83 . . 0 "[ ]"
103 . 3 31 ARG N 3 31 ARG CA 3 31 ARG CB 3 31 ARG CG -80.00 -40.00 -87.35 -87.35 -87.35 7.35 1 1 [+]
104 . 3 33 SER N 3 33 SER CA 3 33 SER CB 3 33 SER OG -90.00 -30.00 -88.31 -88.31 -88.31 . . 0 "[ ]"
105 . 3 34 GLU N 3 34 GLU CA 3 34 GLU CB 3 34 GLU CG -80.00 -40.00 -59.73 -59.73 -59.73 . . 0 "[ ]"
106 . 3 35 ILE N 3 35 ILE CA 3 35 ILE CB 3 35 ILE CG1 160.00 -160.00 157.66 157.66 157.66 2.34 1 0 "[ ]"
107 . 3 36 SER N 3 36 SER CA 3 36 SER CB 3 36 SER OG -80.00 -40.00 -62.41 -62.41 -62.41 . . 0 "[ ]"
108 . 3 37 LYS N 3 37 LYS CA 3 37 LYS CB 3 37 LYS CG -80.00 -40.00 -66.94 -66.94 -66.94 . . 0 "[ ]"
109 . 3 38 GLN N 3 38 GLN CA 3 38 GLN CB 3 38 GLN CG -80.00 -40.00 -72.18 -72.18 -72.18 . . 0 "[ ]"
110 . 3 39 LEU N 3 39 LEU CA 3 39 LEU CB 3 39 LEU CG -80.00 -40.00 -74.64 -74.64 -74.64 . . 0 "[ ]"
111 . 3 41 TYR N 3 41 TYR CA 3 41 TYR CB 3 41 TYR CG 160.00 -160.00 165.10 165.10 165.10 . . 0 "[ ]"
112 . 3 42 GLN N 3 42 GLN CA 3 42 GLN CB 3 42 GLN CG -80.00 -40.00 -80.50 -80.50 -80.50 0.50 1 0 "[ ]"
113 . 3 43 TRP N 3 43 TRP CA 3 43 TRP CB 3 43 TRP CG -80.00 -40.00 -57.51 -57.51 -57.51 . . 0 "[ ]"
114 . 3 44 LYS N 3 44 LYS CA 3 44 LYS CB 3 44 LYS CG -80.00 -40.00 -68.15 -68.15 -68.15 . . 0 "[ ]"
115 . 3 45 MET N 3 45 MET CA 3 45 MET CB 3 45 MET CG -80.00 -40.00 -61.21 -61.21 -61.21 . . 0 "[ ]"
116 . 3 46 LEU N 3 46 LEU CA 3 46 LEU CB 3 46 LEU CG -80.00 -40.00 -70.02 -70.02 -70.02 . . 0 "[ ]"
117 . 3 47 THR N 3 47 THR CA 3 47 THR CB 3 47 THR OG1 40.00 80.00 59.80 59.80 59.80 . . 0 "[ ]"
118 . 3 48 GLU N 3 48 GLU CA 3 48 GLU CB 3 48 GLU CG -80.00 -40.00 -53.99 -53.99 -53.99 . . 0 "[ ]"
119 . 3 50 GLU N 3 50 GLU CA 3 50 GLU CB 3 50 GLU CG -80.00 -40.00 -80.20 -80.20 -80.20 0.20 1 0 "[ ]"
120 . 3 51 LYS N 3 51 LYS CA 3 51 LYS CB 3 51 LYS CG -80.00 -40.00 -61.02 -61.02 -61.02 . . 0 "[ ]"
121 . 3 52 TRP N 3 52 TRP CA 3 52 TRP CB 3 52 TRP CG 160.00 -160.00 177.69 177.69 177.69 . . 0 "[ ]"
122 . 3 54 PHE N 3 54 PHE CA 3 54 PHE CB 3 54 PHE CG 40.00 80.00 72.02 72.02 72.02 . . 0 "[ ]"
123 . 3 55 PHE N 3 55 PHE CA 3 55 PHE CB 3 55 PHE CG -90.00 -30.00 -90.36 -90.36 -90.36 0.36 1 0 "[ ]"
124 . 3 56 GLN N 3 56 GLN CA 3 56 GLN CB 3 56 GLN CG -80.00 -40.00 -80.29 -80.29 -80.29 0.29 1 0 "[ ]"
125 . 3 57 GLU N 3 57 GLU CA 3 57 GLU CB 3 57 GLU CG 160.00 -160.00 166.88 166.88 166.88 . . 0 "[ ]"
126 . 3 59 GLN N 3 59 GLN CA 3 59 GLN CB 3 59 GLN CG -80.00 -40.00 -74.50 -74.50 -74.50 . . 0 "[ ]"
127 . 3 60 LYS N 3 60 LYS CA 3 60 LYS CB 3 60 LYS CG 40.00 80.00 55.78 55.78 55.78 . . 0 "[ ]"
128 . 3 61 LEU N 3 61 LEU CA 3 61 LEU CB 3 61 LEU CG -80.00 -40.00 -84.78 -84.78 -84.78 4.78 1 0 "[ ]"
129 . 3 64 MET N 3 64 MET CA 3 64 MET CB 3 64 MET CG -80.00 -40.00 -58.78 -58.78 -58.78 . . 0 "[ ]"
130 . 3 65 HIS N 3 65 HIS CA 3 65 HIS CB 3 65 HIS CG -80.00 -40.00 -48.14 -48.14 -48.14 . . 0 "[ ]"
131 . 3 67 GLU N 3 67 GLU CA 3 67 GLU CB 3 67 GLU CG -80.00 -40.00 -62.25 -62.25 -62.25 . . 0 "[ ]"
132 . 3 68 LYS N 3 68 LYS CA 3 68 LYS CB 3 68 LYS CG -80.00 -40.00 -76.53 -76.53 -76.53 . . 0 "[ ]"
133 . 3 69 TYR N 3 69 TYR CA 3 69 TYR CB 3 69 TYR CG -80.00 -40.00 -62.43 -62.43 -62.43 . . 0 "[ ]"
134 . 3 71 ASN N 3 71 ASN CA 3 71 ASN CB 3 71 ASN CG -80.00 -40.00 -47.62 -47.62 -47.62 . . 0 "[ ]"
135 . 3 72 TYR N 3 72 TYR CA 3 72 TYR CB 3 72 TYR CG 160.00 -160.00 -162.08 -162.08 -162.08 . . 0 "[ ]"
136 . 3 73 LYS N 3 73 LYS CA 3 73 LYS CB 3 73 LYS CG -80.00 -40.00 -54.08 -54.08 -54.08 . . 0 "[ ]"
137 . 3 74 TYR N 3 74 TYR CA 3 74 TYR CB 3 74 TYR CG -80.00 -40.00 -78.78 -78.78 -78.78 . . 0 "[ ]"
138 . 3 12 PHE CA 3 12 PHE CB 3 12 PHE CG 3 12 PHE CD1 70.00 110.00 76.97 76.97 76.97 . . 0 "[ ]"
139 . 3 15 TRP CA 3 15 TRP CB 3 15 TRP CG 3 15 TRP CD1 -70.00 -30.00 -50.10 -50.10 -50.10 . . 0 "[ ]"
140 . 3 41 TYR CA 3 41 TYR CB 3 41 TYR CG 3 41 TYR CD1 70.00 110.00 88.98 88.98 88.98 . . 0 "[ ]"
141 . 3 52 TRP CA 3 52 TRP CB 3 52 TRP CG 3 52 TRP CD1 40.00 80.00 56.55 56.55 56.55 . . 0 "[ ]"
142 . 3 54 PHE CA 3 54 PHE CB 3 54 PHE CG 3 54 PHE CD1 70.00 110.00 80.25 80.25 80.25 . . 0 "[ ]"
143 . 3 55 PHE CA 3 55 PHE CB 3 55 PHE CG 3 55 PHE CD1 70.00 110.00 70.02 70.02 70.02 . . 0 "[ ]"
144 . 3 65 HIS CA 3 65 HIS CB 3 65 HIS CG 3 65 HIS ND1 150.00 -150.00 148.54 148.54 148.54 1.46 1 0 "[ ]"
145 . 3 69 TYR CA 3 69 TYR CB 3 69 TYR CG 3 69 TYR CD1 60.00 120.00 100.12 100.12 100.12 . . 0 "[ ]"
146 . 3 72 TYR CA 3 72 TYR CB 3 72 TYR CG 3 72 TYR CD1 60.00 120.00 96.27 96.27 96.27 . . 0 "[ ]"
147 . 3 74 TYR CA 3 74 TYR CB 3 74 TYR CG 3 74 TYR CD1 60.00 120.00 91.60 91.60 91.60 . . 0 "[ ]"
148 . 3 13 ILE CA 3 13 ILE CB 3 13 ILE CG1 3 13 ILE CD1 160.00 -160.00 167.28 167.28 167.28 . . 0 "[ ]"
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155 . 1 1 DG C3' 1 1 DG O3' 1 2 DC P 1 2 DC O5' -135.00 -35.00 -76.98 -76.98 -76.98 . . 0 "[ ]"
156 . 1 1 DG O3' 1 2 DC P 1 2 DC O5' 1 2 DC C5' -110.00 -10.00 -91.23 -91.23 -91.23 . . 0 "[ ]"
157 . 1 2 DC P 1 2 DC O5' 1 2 DC C5' 1 2 DC C4' 130.00 -130.00 173.53 173.53 173.53 . . 0 "[ ]"
158 . 1 2 DC C4' 1 2 DC C3' 1 2 DC O3' 1 3 DA P 130.00 -130.00 -161.76 -161.76 -161.76 . . 0 "[ ]"
159 . 1 2 DC C3' 1 2 DC O3' 1 3 DA P 1 3 DA O5' -135.00 -35.00 -78.80 -78.80 -78.80 . . 0 "[ ]"
160 . 1 2 DC O3' 1 3 DA P 1 3 DA O5' 1 3 DA C5' -110.00 -10.00 -95.84 -95.84 -95.84 . . 0 "[ ]"
161 . 1 3 DA P 1 3 DA O5' 1 3 DA C5' 1 3 DA C4' 130.00 -130.00 -162.45 -162.45 -162.45 . . 0 "[ ]"
162 . 1 3 DA C4' 1 3 DA C3' 1 3 DA O3' 1 4 DC P 130.00 -130.00 -171.52 -171.52 -171.52 . . 0 "[ ]"
163 . 1 3 DA C3' 1 3 DA O3' 1 4 DC P 1 4 DC O5' -135.00 -35.00 -83.10 -83.10 -83.10 . . 0 "[ ]"
164 . 1 3 DA O3' 1 4 DC P 1 4 DC O5' 1 4 DC C5' -110.00 -10.00 -66.86 -66.86 -66.86 . . 0 "[ ]"
165 . 1 4 DC P 1 4 DC O5' 1 4 DC C5' 1 4 DC C4' 130.00 -130.00 177.22 177.22 177.22 . . 0 "[ ]"
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167 . 1 4 DC C3' 1 4 DC O3' 1 5 DA P 1 5 DA O5' -135.00 -35.00 -92.73 -92.73 -92.73 . . 0 "[ ]"
168 . 1 4 DC O3' 1 5 DA P 1 5 DA O5' 1 5 DA C5' -110.00 -10.00 -73.85 -73.85 -73.85 . . 0 "[ ]"
169 . 1 5 DA P 1 5 DA O5' 1 5 DA C5' 1 5 DA C4' 130.00 -130.00 164.96 164.96 164.96 . . 0 "[ ]"
170 . 1 5 DA C4' 1 5 DA C3' 1 5 DA O3' 1 6 DA P 130.00 -130.00 -153.78 -153.78 -153.78 . . 0 "[ ]"
171 . 1 5 DA C3' 1 5 DA O3' 1 6 DA P 1 6 DA O5' -135.00 -35.00 -31.39 -31.39 -31.39 3.61 1 0 "[ ]"
172 . 1 5 DA O3' 1 6 DA P 1 6 DA O5' 1 6 DA C5' -110.00 -10.00 -80.51 -80.51 -80.51 . . 0 "[ ]"
173 . 1 6 DA P 1 6 DA O5' 1 6 DA C5' 1 6 DA C4' 130.00 -130.00 -147.74 -147.74 -147.74 . . 0 "[ ]"
174 . 1 6 DA C4' 1 6 DA C3' 1 6 DA O3' 1 7 DA P 130.00 -130.00 -169.63 -169.63 -169.63 . . 0 "[ ]"
175 . 1 6 DA C3' 1 6 DA O3' 1 7 DA P 1 7 DA O5' -135.00 -35.00 -86.10 -86.10 -86.10 . . 0 "[ ]"
176 . 1 6 DA O3' 1 7 DA P 1 7 DA O5' 1 7 DA C5' -110.00 -10.00 -56.90 -56.90 -56.90 . . 0 "[ ]"
177 . 1 7 DA P 1 7 DA O5' 1 7 DA C5' 1 7 DA C4' 130.00 -130.00 167.97 167.97 167.97 . . 0 "[ ]"
178 . 1 7 DA C4' 1 7 DA C3' 1 7 DA O3' 1 8 DC P 130.00 -130.00 -169.95 -169.95 -169.95 . . 0 "[ ]"
179 . 1 7 DA C3' 1 7 DA O3' 1 8 DC P 1 8 DC O5' -135.00 -35.00 -89.48 -89.48 -89.48 . . 0 "[ ]"
180 . 1 7 DA O3' 1 8 DC P 1 8 DC O5' 1 8 DC C5' -110.00 -10.00 -104.97 -104.97 -104.97 . . 0 "[ ]"
181 . 1 8 DC P 1 8 DC O5' 1 8 DC C5' 1 8 DC C4' 130.00 -130.00 156.84 156.84 156.84 . . 0 "[ ]"
182 . 2 1 DG C4' 2 1 DG C3' 2 1 DG O3' 2 2 DT P 130.00 -130.00 -133.89 -133.89 -133.89 . . 0 "[ ]"
183 . 2 1 DG C3' 2 1 DG O3' 2 2 DT P 2 2 DT O5' -135.00 -35.00 -33.62 -33.62 -33.62 1.38 1 0 "[ ]"
184 . 2 1 DG O3' 2 2 DT P 2 2 DT O5' 2 2 DT C5' -110.00 -10.00 -65.89 -65.89 -65.89 . . 0 "[ ]"
185 . 2 2 DT P 2 2 DT O5' 2 2 DT C5' 2 2 DT C4' 130.00 -130.00 -178.15 -178.15 -178.15 . . 0 "[ ]"
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188 . 2 2 DT O3' 2 3 DT P 2 3 DT O5' 2 3 DT C5' -110.00 -10.00 -49.94 -49.94 -49.94 . . 0 "[ ]"
189 . 2 3 DT P 2 3 DT O5' 2 3 DT C5' 2 3 DT C4' 130.00 -130.00 166.46 166.46 166.46 . . 0 "[ ]"
190 . 2 3 DT C4' 2 3 DT C3' 2 3 DT O3' 2 4 DT P 130.00 -130.00 -134.32 -134.32 -134.32 . . 0 "[ ]"
191 . 2 3 DT C3' 2 3 DT O3' 2 4 DT P 2 4 DT O5' -135.00 -35.00 -89.94 -89.94 -89.94 . . 0 "[ ]"
192 . 2 3 DT O3' 2 4 DT P 2 4 DT O5' 2 4 DT C5' -110.00 -10.00 -58.46 -58.46 -58.46 . . 0 "[ ]"
193 . 2 4 DT P 2 4 DT O5' 2 4 DT C5' 2 4 DT C4' 130.00 -130.00 153.10 153.10 153.10 . . 0 "[ ]"
194 . 2 4 DT C4' 2 4 DT C3' 2 4 DT O3' 2 5 DG P 130.00 -130.00 -155.82 -155.82 -155.82 . . 0 "[ ]"
195 . 2 4 DT C3' 2 4 DT O3' 2 5 DG P 2 5 DG O5' -135.00 -35.00 -102.84 -102.84 -102.84 . . 0 "[ ]"
196 . 2 4 DT O3' 2 5 DG P 2 5 DG O5' 2 5 DG C5' -110.00 -10.00 -55.96 -55.96 -55.96 . . 0 "[ ]"
197 . 2 5 DG P 2 5 DG O5' 2 5 DG C5' 2 5 DG C4' 130.00 -130.00 172.85 172.85 172.85 . . 0 "[ ]"
198 . 2 5 DG C4' 2 5 DG C3' 2 5 DG O3' 2 6 DT P 130.00 -130.00 -166.66 -166.66 -166.66 . . 0 "[ ]"
199 . 2 5 DG C3' 2 5 DG O3' 2 6 DT P 2 6 DT O5' -135.00 -35.00 -87.06 -87.06 -87.06 . . 0 "[ ]"
200 . 2 5 DG O3' 2 6 DT P 2 6 DT O5' 2 6 DT C5' -110.00 -10.00 -68.60 -68.60 -68.60 . . 0 "[ ]"
201 . 2 6 DT P 2 6 DT O5' 2 6 DT C5' 2 6 DT C4' 130.00 -130.00 171.97 171.97 171.97 . . 0 "[ ]"
202 . 2 6 DT C4' 2 6 DT C3' 2 6 DT O3' 2 7 DG P 130.00 -130.00 -153.92 -153.92 -153.92 . . 0 "[ ]"
203 . 2 6 DT C3' 2 6 DT O3' 2 7 DG P 2 7 DG O5' -135.00 -35.00 -83.30 -83.30 -83.30 . . 0 "[ ]"
204 . 2 6 DT O3' 2 7 DG P 2 7 DG O5' 2 7 DG C5' -110.00 -10.00 -67.76 -67.76 -67.76 . . 0 "[ ]"
205 . 2 7 DG P 2 7 DG O5' 2 7 DG C5' 2 7 DG C4' 130.00 -130.00 -179.56 -179.56 -179.56 . . 0 "[ ]"
206 . 2 7 DG C4' 2 7 DG C3' 2 7 DG O3' 2 8 DC P 130.00 -130.00 -165.39 -165.39 -165.39 . . 0 "[ ]"
207 . 2 7 DG C3' 2 7 DG O3' 2 8 DC P 2 8 DC O5' -135.00 -35.00 -81.13 -81.13 -81.13 . . 0 "[ ]"
208 . 2 7 DG O3' 2 8 DC P 2 8 DC O5' 2 8 DC C5' -110.00 -10.00 -87.92 -87.92 -87.92 . . 0 "[ ]"
209 . 2 8 DC P 2 8 DC O5' 2 8 DC C5' 2 8 DC C4' 130.00 -130.00 179.52 179.52 179.52 . . 0 "[ ]"
210 . 1 1 DG C5' 1 1 DG C4' 1 1 DG C3' 1 1 DG O3' 10.00 170.00 108.11 108.11 108.11 . . 0 "[ ]"
211 . 1 2 DC C5' 1 2 DC C4' 1 2 DC C3' 1 2 DC O3' 40.00 140.00 104.52 104.52 104.52 . . 0 "[ ]"
212 . 1 3 DA C5' 1 3 DA C4' 1 3 DA C3' 1 3 DA O3' 40.00 140.00 108.64 108.64 108.64 . . 0 "[ ]"
213 . 1 4 DC C5' 1 4 DC C4' 1 4 DC C3' 1 4 DC O3' 40.00 140.00 106.29 106.29 106.29 . . 0 "[ ]"
214 . 1 5 DA C5' 1 5 DA C4' 1 5 DA C3' 1 5 DA O3' 20.00 140.00 18.02 18.02 18.02 1.98 1 0 "[ ]"
215 . 1 6 DA C5' 1 6 DA C4' 1 6 DA C3' 1 6 DA O3' 40.00 140.00 115.65 115.65 115.65 . . 0 "[ ]"
216 . 1 7 DA C5' 1 7 DA C4' 1 7 DA C3' 1 7 DA O3' 10.00 170.00 106.48 106.48 106.48 . . 0 "[ ]"
217 . 1 8 DC C5' 1 8 DC C4' 1 8 DC C3' 1 8 DC O3' 40.00 140.00 95.01 95.01 95.01 . . 0 "[ ]"
218 . 2 1 DG C5' 2 1 DG C4' 2 1 DG C3' 2 1 DG O3' 10.00 170.00 19.18 19.18 19.18 . . 0 "[ ]"
219 . 2 2 DT C5' 2 2 DT C4' 2 2 DT C3' 2 2 DT O3' 40.00 140.00 99.82 99.82 99.82 . . 0 "[ ]"
220 . 2 3 DT C5' 2 3 DT C4' 2 3 DT C3' 2 3 DT O3' 40.00 140.00 98.29 98.29 98.29 . . 0 "[ ]"
221 . 2 4 DT C5' 2 4 DT C4' 2 4 DT C3' 2 4 DT O3' 40.00 140.00 105.57 105.57 105.57 . . 0 "[ ]"
222 . 2 5 DG C5' 2 5 DG C4' 2 5 DG C3' 2 5 DG O3' 10.00 170.00 121.36 121.36 121.36 . . 0 "[ ]"
223 . 2 6 DT C5' 2 6 DT C4' 2 6 DT C3' 2 6 DT O3' 40.00 140.00 102.05 102.05 102.05 . . 0 "[ ]"
224 . 2 7 DG C5' 2 7 DG C4' 2 7 DG C3' 2 7 DG O3' 40.00 140.00 105.52 105.52 105.52 . . 0 "[ ]"
225 . 2 8 DC C5' 2 8 DC C4' 2 8 DC C3' 2 8 DC O3' 40.00 140.00 98.32 98.32 98.32 . . 0 "[ ]"
226 . 1 1 DG O5' 1 1 DG C5' 1 1 DG C4' 1 1 DG C3' 25.00 95.00 41.73 41.73 41.73 . . 0 "[ ]"
227 . 1 2 DC O5' 1 2 DC C5' 1 2 DC C4' 1 2 DC C3' 25.00 95.00 73.63 73.63 73.63 . . 0 "[ ]"
228 . 1 3 DA O5' 1 3 DA C5' 1 3 DA C4' 1 3 DA C3' 25.00 95.00 54.04 54.04 54.04 . . 0 "[ ]"
229 . 1 4 DC O5' 1 4 DC C5' 1 4 DC C4' 1 4 DC C3' 25.00 95.00 51.87 51.87 51.87 . . 0 "[ ]"
230 . 1 5 DA O5' 1 5 DA C5' 1 5 DA C4' 1 5 DA C3' 25.00 95.00 76.09 76.09 76.09 . . 0 "[ ]"
231 . 1 6 DA O5' 1 6 DA C5' 1 6 DA C4' 1 6 DA C3' 25.00 95.00 69.11 69.11 69.11 . . 0 "[ ]"
232 . 1 7 DA O5' 1 7 DA C5' 1 7 DA C4' 1 7 DA C3' 25.00 95.00 49.85 49.85 49.85 . . 0 "[ ]"
233 . 1 8 DC O5' 1 8 DC C5' 1 8 DC C4' 1 8 DC C3' 25.00 95.00 96.09 96.09 96.09 1.09 1 0 "[ ]"
234 . 2 1 DG O5' 2 1 DG C5' 2 1 DG C4' 2 1 DG C3' 25.00 95.00 46.29 46.29 46.29 . . 0 "[ ]"
235 . 2 2 DT O5' 2 2 DT C5' 2 2 DT C4' 2 2 DT C3' 25.00 95.00 77.19 77.19 77.19 . . 0 "[ ]"
236 . 2 3 DT O5' 2 3 DT C5' 2 3 DT C4' 2 3 DT C3' 25.00 95.00 52.56 52.56 52.56 . . 0 "[ ]"
237 . 2 4 DT O5' 2 4 DT C5' 2 4 DT C4' 2 4 DT C3' 25.00 95.00 62.05 62.05 62.05 . . 0 "[ ]"
238 . 2 5 DG O5' 2 5 DG C5' 2 5 DG C4' 2 5 DG C3' 25.00 95.00 44.65 44.65 44.65 . . 0 "[ ]"
239 . 2 6 DT O5' 2 6 DT C5' 2 6 DT C4' 2 6 DT C3' 25.00 95.00 52.45 52.45 52.45 . . 0 "[ ]"
240 . 2 7 DG O5' 2 7 DG C5' 2 7 DG C4' 2 7 DG C3' 25.00 95.00 37.16 37.16 37.16 . . 0 "[ ]"
241 . 2 8 DC O5' 2 8 DC C5' 2 8 DC C4' 2 8 DC C3' 25.00 95.00 60.76 60.76 60.76 . . 0 "[ ]"
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Contact the webmaster for help, if required. Tuesday, May 14, 2024 7:50:58 AM GMT (wattos1)