NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
398764 |
1tq1   |
6240 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1tq1
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 85
_TA_constraint_stats_list.Viol_count 111
_TA_constraint_stats_list.Viol_total 1352.82
_TA_constraint_stats_list.Viol_max 11.08
_TA_constraint_stats_list.Viol_rms 1.64
_TA_constraint_stats_list.Viol_average_all_restraints 0.64
_TA_constraint_stats_list.Viol_average_violations_only 2.44
_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 16 VAL N 1 16 VAL CA 1 16 VAL C 1 17 PRO N 109.00 177.00 157.36 149.00 101.75 7.25 1 1 "[+ .]"
2 . 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 SER N 80.00 160.00 147.68 138.99 152.55 . . 0 "[ .]"
3 . 1 19 SER N 1 19 SER CA 1 19 SER C 1 20 VAL N 110.00 174.00 144.80 139.55 151.51 . . 0 "[ .]"
4 . 1 20 VAL N 1 20 VAL CA 1 20 VAL C 1 21 SER N 127.00 179.00 174.06 158.61 -179.04 1.96 1 0 "[ .]"
5 . 1 21 SER N 1 21 SER CA 1 21 SER C 1 22 VAL N 145.00 -171.00 155.50 151.34 148.19 . . 0 "[ .]"
6 . 1 22 VAL N 1 22 VAL CA 1 22 VAL C 1 23 THR N -54.00 -22.00 -28.63 -33.21 -21.24 0.76 1 0 "[ .]"
7 . 1 23 THR N 1 23 THR CA 1 23 THR C 1 24 VAL N -55.00 -27.00 -54.92 -58.20 -47.78 3.20 2 0 "[ .]"
8 . 1 24 VAL N 1 24 VAL CA 1 24 VAL C 1 25 ALA N -52.00 -36.00 -37.15 -35.66 -39.74 1.26 4 0 "[ .]"
9 . 1 25 ALA N 1 25 ALA CA 1 25 ALA C 1 26 HIS N -45.00 -37.00 -36.44 -37.43 -35.04 1.96 1 0 "[ .]"
10 . 1 26 HIS N 1 26 HIS CA 1 26 HIS C 1 27 ASP N -54.00 -30.00 -46.85 -44.09 -46.66 . . 0 "[ .]"
11 . 1 27 ASP N 1 27 ASP CA 1 27 ASP C 1 28 LEU N -53.00 -29.00 -41.97 -44.45 -36.15 . . 0 "[ .]"
12 . 1 29 LEU N 1 29 LEU CA 1 29 LEU C 1 30 LEU N -59.00 -27.00 -41.16 -43.38 -39.19 . . 0 "[ .]"
13 . 1 30 LEU N 1 30 LEU CA 1 30 LEU C 1 31 ALA N -48.00 -12.00 -27.19 -34.71 -14.39 . . 0 "[ .]"
14 . 1 31 ALA N 1 31 ALA CA 1 31 ALA C 1 32 GLY N -28.00 28.00 -25.52 -28.87 -19.87 0.87 3 0 "[ .]"
15 . 1 32 GLY N 1 32 GLY CA 1 32 GLY C 1 33 HIS N -15.00 49.00 48.54 47.28 49.60 0.60 4 0 "[ .]"
16 . 1 34 ARG N 1 34 ARG CA 1 34 ARG C 1 35 TYR N 110.00 174.00 135.91 141.11 133.68 . . 0 "[ .]"
17 . 1 35 TYR N 1 35 TYR CA 1 35 TYR C 1 36 LEU N 105.00 141.00 111.72 106.64 118.06 . . 0 "[ .]"
18 . 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 ASP N 102.00 142.00 121.78 101.22 135.44 0.78 2 0 "[ .]"
19 . 1 37 ASP N 1 37 ASP CA 1 37 ASP C 1 38 VAL N 102.00 166.00 134.48 157.30 142.50 . . 0 "[ .]"
20 . 1 38 VAL N 1 38 VAL CA 1 38 VAL C 1 39 ARG N 48.00 -136.00 90.46 75.31 103.97 . . 0 "[ .]"
21 . 1 39 ARG N 1 39 ARG CA 1 39 ARG C 1 40 THR N -35.00 1.00 -44.42 -45.30 -45.32 11.08 4 5 [**-+*]
22 . 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 GLU N -63.00 -19.00 -30.57 -37.75 -23.44 . . 0 "[ .]"
23 . 1 43 GLU N 1 43 GLU CA 1 43 GLU C 1 44 PHE N -54.00 -30.00 -31.06 -28.68 -30.00 1.32 2 0 "[ .]"
24 . 1 44 PHE N 1 44 PHE CA 1 44 PHE C 1 45 SER N -62.00 -18.00 -38.85 -42.39 -44.21 . . 0 "[ .]"
25 . 1 45 SER N 1 45 SER CA 1 45 SER C 1 46 GLN N -45.00 -9.00 -35.22 -48.36 -19.10 3.36 4 0 "[ .]"
26 . 1 46 GLN N 1 46 GLN CA 1 46 GLN C 1 47 GLY N -36.00 12.00 -19.13 -37.27 9.50 1.27 2 0 "[ .]"
27 . 1 47 GLY N 1 47 GLY CA 1 47 GLY C 1 48 HIS N -164.00 -140.00 -157.15 -139.57 -148.38 8.53 4 1 "[ +.]"
28 . 1 48 HIS N 1 48 HIS CA 1 48 HIS C 1 49 ALA N 107.00 -165.00 164.20 101.71 -159.32 5.68 3 2 "[ +-.]"
29 . 1 49 ALA N 1 49 ALA CA 1 49 ALA C 1 50 CYS N 92.00 168.00 160.29 147.70 169.58 1.58 3 0 "[ .]"
30 . 1 51 GLY N 1 51 GLY CA 1 51 GLY C 1 52 ALA N -51.00 25.00 4.78 -51.39 26.50 1.50 1 0 "[ .]"
31 . 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 ILE N 125.00 -175.00 152.07 157.78 124.26 1.85 1 0 "[ .]"
32 . 1 53 ILE N 1 53 ILE CA 1 53 ILE C 1 54 ASN N 103.00 151.00 127.94 134.83 113.19 . . 0 "[ .]"
33 . 1 54 ASN N 1 54 ASN CA 1 54 ASN C 1 55 VAL N 116.00 144.00 132.39 130.79 118.33 . . 0 "[ .]"
34 . 1 55 VAL N 1 55 VAL CA 1 55 VAL C 1 56 PRO N 94.00 162.00 120.70 165.37 163.34 3.37 2 0 "[ .]"
35 . 1 58 MET N 1 58 MET CA 1 58 MET C 1 59 ASN N 132.00 172.00 139.73 127.67 149.71 4.33 2 0 "[ .]"
36 . 1 59 ASN N 1 59 ASN CA 1 59 ASN C 1 60 ARG N 100.00 172.00 118.68 98.58 133.27 1.42 5 0 "[ .]"
37 . 1 60 ARG N 1 60 ARG CA 1 60 ARG C 1 61 GLY N 108.00 144.00 128.21 122.16 137.31 . . 0 "[ .]"
38 . 1 63 SER N 1 63 SER CA 1 63 SER C 1 64 GLY N -28.00 28.00 3.40 6.35 -8.59 . . 0 "[ .]"
39 . 1 66 SER N 1 66 SER CA 1 66 SER C 1 67 LYS N 95.00 175.00 93.84 91.96 97.63 3.04 2 0 "[ .]"
40 . 1 67 LYS N 1 67 LYS CA 1 67 LYS C 1 68 ASN N 106.00 166.00 135.71 142.98 121.91 . . 0 "[ .]"
41 . 1 68 ASN N 1 68 ASN CA 1 68 ASN C 1 69 THR N 33.00 -175.00 122.66 90.80 168.50 . . 0 "[ .]"
42 . 1 71 PHE N 1 71 PHE CA 1 71 PHE C 1 72 LEU N -62.00 -26.00 -24.39 -23.63 -24.23 3.98 3 0 "[ .]"
43 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 GLU N -57.00 -25.00 -46.59 -52.34 -42.47 . . 0 "[ .]"
44 . 1 73 GLU N 1 73 GLU CA 1 73 GLU C 1 74 GLN N -55.00 -31.00 -37.22 -37.75 -40.85 . . 0 "[ .]"
45 . 1 74 GLN N 1 74 GLN CA 1 74 GLN C 1 75 VAL N -50.00 -22.00 -48.44 -51.66 -45.12 1.66 2 0 "[ .]"
46 . 1 75 VAL N 1 75 VAL CA 1 75 VAL C 1 76 SER N -53.00 -37.00 -47.53 -48.57 -54.00 1.00 1 0 "[ .]"
47 . 1 76 SER N 1 76 SER CA 1 76 SER C 1 77 SER N -56.00 4.00 -24.89 -36.99 -14.49 . . 0 "[ .]"
48 . 1 77 SER N 1 77 SER CA 1 77 SER C 1 78 HIS N -58.00 -2.00 -23.74 -32.31 -37.56 3.39 4 0 "[ .]"
49 . 1 79 PHE N 1 79 PHE CA 1 79 PHE C 1 80 GLY N 123.00 175.00 148.59 169.77 151.24 . . 0 "[ .]"
50 . 1 80 GLY N 1 80 GLY CA 1 80 GLY C 1 81 GLN N 139.00 -177.00 137.97 137.79 136.24 4.22 4 0 "[ .]"
51 . 1 81 GLN N 1 81 GLN CA 1 81 GLN C 1 82 SER N -53.00 -9.00 -25.63 -21.19 -25.92 . . 0 "[ .]"
52 . 1 82 SER N 1 82 SER CA 1 82 SER C 1 83 ASP N -22.00 14.00 20.24 15.54 24.15 10.15 3 3 "[* + -]"
53 . 1 83 ASP N 1 83 ASP CA 1 83 ASP C 1 84 ASN N 93.00 -175.00 113.11 107.46 118.07 . . 0 "[ .]"
54 . 1 85 ILE N 1 85 ILE CA 1 85 ILE C 1 86 ILE N 126.00 174.00 174.95 168.84 177.67 3.67 3 0 "[ .]"
55 . 1 86 ILE N 1 86 ILE CA 1 86 ILE C 1 87 VAL N 111.00 155.00 110.10 109.66 108.33 3.52 1 0 "[ .]"
56 . 1 87 VAL N 1 87 VAL CA 1 87 VAL C 1 88 GLY N 101.00 -171.00 168.74 166.47 155.11 . . 0 "[ .]"
57 . 1 88 GLY N 1 88 GLY CA 1 88 GLY C 1 89 CYS N 115.00 175.00 147.33 140.13 138.24 0.63 5 0 "[ .]"
58 . 1 89 CYS N 1 89 CYS CA 1 89 CYS C 1 90 GLN N 91.00 -161.00 140.04 120.31 148.30 . . 0 "[ .]"
59 . 1 91 SER N 1 91 SER CA 1 91 SER C 1 92 GLY N 106.00 158.00 159.76 160.22 159.02 2.98 5 0 "[ .]"
60 . 1 94 ARG N 1 94 ARG CA 1 94 ARG C 1 95 SER N -60.00 -24.00 -31.85 -29.59 -36.05 . . 0 "[ .]"
61 . 1 95 SER N 1 95 SER CA 1 95 SER C 1 96 ILE N -55.00 -15.00 -30.62 -39.48 -24.49 . . 0 "[ .]"
62 . 1 96 ILE N 1 96 ILE CA 1 96 ILE C 1 97 LYS N -49.00 -29.00 -41.30 -30.90 -47.45 . . 0 "[ .]"
63 . 1 97 LYS N 1 97 LYS CA 1 97 LYS C 1 98 ALA N -47.00 -31.00 -40.08 -47.68 -30.87 0.68 5 0 "[ .]"
64 . 1 98 ALA N 1 98 ALA CA 1 98 ALA C 1 99 THR N -51.00 -31.00 -41.09 -33.24 -38.11 . . 0 "[ .]"
65 . 1 99 THR N 1 99 THR CA 1 99 THR C 1 100 THR N -56.00 -32.00 -49.26 -57.84 -35.37 1.84 2 0 "[ .]"
66 . 1 102 LEU N 1 102 LEU CA 1 102 LEU C 1 103 LEU N -51.00 -27.00 -40.74 -44.45 -35.03 . . 0 "[ .]"
67 . 1 103 LEU N 1 103 LEU CA 1 103 LEU C 1 104 HIS N -54.00 -22.00 -34.94 -36.84 -38.58 . . 0 "[ .]"
68 . 1 104 HIS N 1 104 HIS CA 1 104 HIS C 1 105 ALA N -35.00 -15.00 -28.02 -18.58 -32.54 1.48 1 0 "[ .]"
69 . 1 105 ALA N 1 105 ALA CA 1 105 ALA C 1 106 GLY N -18.00 34.00 2.46 -19.56 37.20 3.20 5 0 "[ .]"
70 . 1 109 GLY N 1 109 GLY CA 1 109 GLY C 1 110 VAL N -34.00 18.00 20.67 21.13 19.43 5.06 2 1 "[ + .]"
71 . 1 110 VAL N 1 110 VAL CA 1 110 VAL C 1 111 LYS N 111.00 -161.00 163.85 165.67 163.06 . . 0 "[ .]"
72 . 1 111 LYS N 1 111 LYS CA 1 111 LYS C 1 112 ASP N 131.00 171.00 149.70 153.29 148.94 . . 0 "[ .]"
73 . 1 112 ASP N 1 112 ASP CA 1 112 ASP C 1 113 ILE N 102.00 162.00 113.45 115.72 109.78 . . 0 "[ .]"
74 . 1 113 ILE N 1 113 ILE CA 1 113 ILE C 1 114 VAL N 95.00 155.00 140.00 125.10 155.35 0.35 1 0 "[ .]"
75 . 1 114 VAL N 1 114 VAL CA 1 114 VAL C 1 115 GLY N 114.00 150.00 135.84 135.83 124.18 . . 0 "[ .]"
76 . 1 117 TYR N 1 117 TYR CA 1 117 TYR C 1 118 SER N -52.00 -32.00 -42.11 -53.64 -33.02 1.64 2 0 "[ .]"
77 . 1 118 SER N 1 118 SER CA 1 118 SER C 1 119 ALA N -52.00 -32.00 -36.83 -39.27 -45.03 . . 0 "[ .]"
78 . 1 119 ALA N 1 119 ALA CA 1 119 ALA C 1 120 TRP N -51.34 -26.74 -50.17 -54.72 -40.91 3.38 2 0 "[ .]"
79 . 1 120 TRP N 1 120 TRP CA 1 120 TRP C 1 121 ALA N -55.00 -35.00 -36.16 -34.87 -35.54 1.23 5 0 "[ .]"
80 . 1 121 ALA N 1 121 ALA CA 1 121 ALA C 1 122 LYS N -52.53 -26.61 -31.79 -37.63 -25.81 0.80 3 0 "[ .]"
81 . 1 122 LYS N 1 122 LYS CA 1 122 LYS C 1 123 ASN N -53.00 -13.00 -37.59 -26.87 -36.39 . . 0 "[ .]"
82 . 1 123 ASN N 1 123 ASN CA 1 123 ASN C 1 124 GLY N -65.00 55.00 -62.42 -49.26 -64.59 2.68 3 0 "[ .]"
83 . 1 125 LEU N 1 125 LEU CA 1 125 LEU C 1 126 PRO N 64.00 172.00 90.89 98.14 79.75 . . 0 "[ .]"
84 . 1 127 THR N 1 127 THR CA 1 127 THR C 1 128 LYS N 114.00 174.00 126.95 109.45 136.07 4.55 4 0 "[ .]"
85 . 1 128 LYS N 1 128 LYS CA 1 128 LYS C 1 129 ALA N 99.00 167.00 154.34 141.02 168.41 1.41 4 0 "[ .]"
stop_
save_
save_distance_constraint_statistics_2
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 85
_TA_constraint_stats_list.Viol_count 117
_TA_constraint_stats_list.Viol_total 1176.27
_TA_constraint_stats_list.Viol_max 10.87
_TA_constraint_stats_list.Viol_rms 1.33
_TA_constraint_stats_list.Viol_average_all_restraints 0.55
_TA_constraint_stats_list.Viol_average_violations_only 2.01
_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 15 ARG C 1 16 VAL N 1 16 VAL CA 1 16 VAL C -142.00 -58.00 -141.81 -143.11 -144.87 4.85 1 0 "[ .]"
2 . 1 17 PRO C 1 18 SER N 1 18 SER CA 1 18 SER C -163.00 -43.00 -133.63 -161.23 -75.19 . . 0 "[ .]"
3 . 1 18 SER C 1 19 SER N 1 19 SER CA 1 19 SER C -153.00 -69.00 -104.96 -101.02 -108.50 . . 0 "[ .]"
4 . 1 19 SER C 1 20 VAL N 1 20 VAL CA 1 20 VAL C -162.00 -118.00 -150.61 -150.60 -158.81 . . 0 "[ .]"
5 . 1 20 VAL C 1 21 SER N 1 21 SER CA 1 21 SER C -119.00 -55.00 -116.05 -119.55 -108.82 0.55 4 0 "[ .]"
6 . 1 21 SER C 1 22 VAL N 1 22 VAL CA 1 22 VAL C -68.00 -48.00 -51.14 -62.86 -47.32 0.68 1 0 "[ .]"
7 . 1 22 VAL C 1 23 THR N 1 23 THR CA 1 23 THR C -72.00 -56.00 -60.16 -65.10 -55.38 0.62 5 0 "[ .]"
8 . 1 23 THR C 1 24 VAL N 1 24 VAL CA 1 24 VAL C -73.00 -61.00 -66.41 -65.51 -69.68 0.69 2 0 "[ .]"
9 . 1 24 VAL C 1 25 ALA N 1 25 ALA CA 1 25 ALA C -72.00 -52.00 -53.37 -51.30 -55.54 1.08 4 0 "[ .]"
10 . 1 25 ALA C 1 26 HIS N 1 26 HIS CA 1 26 HIS C -71.00 -55.00 -57.33 -60.29 -52.99 2.01 1 0 "[ .]"
11 . 1 26 HIS C 1 27 ASP N 1 27 ASP CA 1 27 ASP C -81.00 -49.00 -59.24 -60.90 -55.33 . . 0 "[ .]"
12 . 1 28 LEU C 1 29 LEU N 1 29 LEU CA 1 29 LEU C -74.00 -54.00 -57.65 -53.54 -56.86 0.46 2 0 "[ .]"
13 . 1 29 LEU C 1 30 LEU N 1 30 LEU CA 1 30 LEU C -84.00 -56.00 -65.76 -80.21 -58.41 . . 0 "[ .]"
14 . 1 30 LEU C 1 31 ALA N 1 31 ALA CA 1 31 ALA C -113.00 -69.00 -67.56 -71.09 -66.19 2.81 3 0 "[ .]"
15 . 1 31 ALA C 1 32 GLY N 1 32 GLY CA 1 32 GLY C 56.00 136.00 83.75 71.19 97.07 . . 0 "[ .]"
16 . 1 33 HIS C 1 34 ARG N 1 34 ARG CA 1 34 ARG C -160.00 -60.00 -59.88 -61.82 -58.66 1.34 1 0 "[ .]"
17 . 1 34 ARG C 1 35 TYR N 1 35 TYR CA 1 35 TYR C -130.00 -82.00 -118.04 -125.62 -109.92 . . 0 "[ .]"
18 . 1 35 TYR C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -123.00 -83.00 -103.12 -122.16 -92.62 . . 0 "[ .]"
19 . 1 36 LEU C 1 37 ASP N 1 37 ASP CA 1 37 ASP C -146.00 -78.00 -123.16 -98.89 -138.45 1.75 5 0 "[ .]"
20 . 1 37 ASP C 1 38 VAL N 1 38 VAL CA 1 38 VAL C -131.00 -55.00 -123.54 -134.17 -83.10 3.17 4 0 "[ .]"
21 . 1 38 VAL C 1 39 ARG N 1 39 ARG CA 1 39 ARG C -83.00 -51.00 -84.44 -84.34 -89.65 6.65 1 1 "[+ .]"
22 . 1 41 PRO C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -72.00 -48.00 -64.62 -72.81 -58.28 0.81 2 0 "[ .]"
23 . 1 42 GLU C 1 43 GLU N 1 43 GLU CA 1 43 GLU C -75.00 -55.00 -54.97 -58.49 -50.66 4.34 5 0 "[ .]"
24 . 1 43 GLU C 1 44 PHE N 1 44 PHE CA 1 44 PHE C -75.00 -47.00 -74.36 -79.06 -67.99 4.06 3 0 "[ .]"
25 . 1 44 PHE C 1 45 SER N 1 45 SER CA 1 45 SER C -75.00 -51.00 -55.47 -54.83 -56.13 1.99 5 0 "[ .]"
26 . 1 45 SER C 1 46 GLN N 1 46 GLN CA 1 46 GLN C -100.00 -72.00 -80.29 -103.73 -69.80 3.73 4 0 "[ .]"
27 . 1 46 GLN C 1 47 GLY N 1 47 GLY CA 1 47 GLY C 33.00 161.00 118.67 137.93 122.06 0.78 5 0 "[ .]"
28 . 1 47 GLY C 1 48 HIS N 1 48 HIS CA 1 48 HIS C -173.00 -65.00 -131.52 176.13 -100.42 10.87 4 1 "[ +.]"
29 . 1 48 HIS C 1 49 ALA N 1 49 ALA CA 1 49 ALA C -151.00 -23.00 -134.24 -160.45 -30.87 9.45 4 1 "[ +.]"
30 . 1 50 CYS C 1 51 GLY N 1 51 GLY CA 1 51 GLY C 75.00 115.00 93.43 87.57 80.79 2.85 4 0 "[ .]"
31 . 1 51 GLY C 1 52 ALA N 1 52 ALA CA 1 52 ALA C 167.00 -45.00 -157.40 -170.46 -149.29 . . 0 "[ .]"
32 . 1 52 ALA C 1 53 ILE N 1 53 ILE CA 1 53 ILE C -149.00 -101.00 -109.30 -101.41 -105.14 1.40 5 0 "[ .]"
33 . 1 53 ILE C 1 54 ASN N 1 54 ASN CA 1 54 ASN C -132.00 -76.00 -116.45 -131.55 -98.03 . . 0 "[ .]"
34 . 1 54 ASN C 1 55 VAL N 1 55 VAL CA 1 55 VAL C -139.00 -67.00 -141.72 -142.99 -140.24 3.99 2 0 "[ .]"
35 . 1 57 TYR C 1 58 MET N 1 58 MET CA 1 58 MET C 162.00 -78.00 -129.48 -154.18 -86.79 . . 0 "[ .]"
36 . 1 58 MET C 1 59 ASN N 1 59 ASN CA 1 59 ASN C -149.00 -81.00 -148.34 -154.83 -142.43 5.83 2 1 "[ + .]"
37 . 1 59 ASN C 1 60 ARG N 1 60 ARG CA 1 60 ARG C -120.00 -56.00 -104.46 -120.56 -78.12 0.56 2 0 "[ .]"
38 . 1 62 ALA C 1 63 SER N 1 63 SER CA 1 63 SER C -128.00 -64.00 -89.14 -127.35 -62.45 1.55 5 0 "[ .]"
39 . 1 65 MET C 1 66 SER N 1 66 SER CA 1 66 SER C 179.00 -77.00 -162.66 -151.50 -161.47 . . 0 "[ .]"
40 . 1 66 SER C 1 67 LYS N 1 67 LYS CA 1 67 LYS C -126.00 -42.00 -112.01 -103.58 -127.54 2.39 3 0 "[ .]"
41 . 1 67 LYS C 1 68 ASN N 1 68 ASN CA 1 68 ASN C -136.00 -28.00 -47.18 -39.08 -40.14 . . 0 "[ .]"
42 . 1 70 ASP C 1 71 PHE N 1 71 PHE CA 1 71 PHE C -70.00 -46.00 -51.52 -57.77 -48.24 . . 0 "[ .]"
43 . 1 71 PHE C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -72.00 -48.00 -50.66 -48.90 -50.79 1.34 3 0 "[ .]"
44 . 1 72 LEU C 1 73 GLU N 1 73 GLU CA 1 73 GLU C -74.00 -54.00 -57.33 -58.27 -60.88 . . 0 "[ .]"
45 . 1 73 GLU C 1 74 GLN N 1 74 GLN CA 1 74 GLN C -84.00 -52.00 -79.29 -73.62 -75.53 . . 0 "[ .]"
46 . 1 74 GLN C 1 75 VAL N 1 75 VAL CA 1 75 VAL C -80.00 -56.00 -69.35 -76.83 -64.76 . . 0 "[ .]"
47 . 1 75 VAL C 1 76 SER N 1 76 SER CA 1 76 SER C -77.00 -53.00 -56.26 -52.78 -58.24 1.32 4 0 "[ .]"
48 . 1 76 SER C 1 77 SER N 1 77 SER CA 1 77 SER C -95.00 -51.00 -60.26 -72.35 -51.21 . . 0 "[ .]"
49 . 1 78 HIS C 1 79 PHE N 1 79 PHE CA 1 79 PHE C -163.00 -83.00 -137.52 -117.19 -142.42 0.53 5 0 "[ .]"
50 . 1 79 PHE C 1 80 GLY N 1 80 GLY CA 1 80 GLY C -112.00 -48.00 -113.37 -109.58 -112.26 4.55 1 0 "[ .]"
51 . 1 80 GLY C 1 81 GLN N 1 81 GLN CA 1 81 GLN C -73.00 -45.00 -46.06 -45.71 -46.56 0.62 3 0 "[ .]"
52 . 1 81 GLN C 1 82 SER N 1 82 SER CA 1 82 SER C -122.00 -74.00 -123.41 -123.73 -125.09 3.09 1 0 "[ .]"
53 . 1 82 SER C 1 83 ASP N 1 83 ASP CA 1 83 ASP C -148.00 -24.00 -39.84 -45.78 -34.97 . . 0 "[ .]"
54 . 1 84 ASN C 1 85 ILE N 1 85 ILE CA 1 85 ILE C -150.00 -114.00 -145.47 -143.10 -145.93 0.14 3 0 "[ .]"
55 . 1 85 ILE C 1 86 ILE N 1 86 ILE CA 1 86 ILE C -149.00 -89.00 -113.12 -110.44 -111.01 . . 0 "[ .]"
56 . 1 86 ILE C 1 87 VAL N 1 87 VAL CA 1 87 VAL C -158.00 -90.00 -109.73 -114.98 -100.56 . . 0 "[ .]"
57 . 1 87 VAL C 1 88 GLY N 1 88 GLY CA 1 88 GLY C -172.00 -92.00 -161.43 -148.97 -162.41 3.09 4 0 "[ .]"
58 . 1 88 GLY C 1 89 CYS N 1 89 CYS CA 1 89 CYS C -166.00 -74.00 -103.22 -90.46 -92.64 . . 0 "[ .]"
59 . 1 90 GLN C 1 91 SER N 1 91 SER CA 1 91 SER C -157.00 -57.00 -103.60 -149.64 -61.52 . . 0 "[ .]"
60 . 1 93 GLY C 1 94 ARG N 1 94 ARG CA 1 94 ARG C -73.00 -57.00 -62.77 -67.57 -55.05 1.95 5 0 "[ .]"
61 . 1 94 ARG C 1 95 SER N 1 95 SER CA 1 95 SER C -84.00 -44.00 -81.10 -62.30 -84.51 3.65 4 0 "[ .]"
62 . 1 95 SER C 1 96 ILE N 1 96 ILE CA 1 96 ILE C -76.00 -56.00 -59.48 -63.73 -55.53 0.47 3 0 "[ .]"
63 . 1 96 ILE C 1 97 LYS N 1 97 LYS CA 1 97 LYS C -70.00 -54.00 -67.89 -70.85 -71.38 1.38 1 0 "[ .]"
64 . 1 97 LYS C 1 98 ALA N 1 98 ALA CA 1 98 ALA C -70.00 -58.00 -62.25 -58.00 -63.89 1.66 5 0 "[ .]"
65 . 1 98 ALA C 1 99 THR N 1 99 THR CA 1 99 THR C -89.00 -37.00 -69.81 -85.88 -57.86 . . 0 "[ .]"
66 . 1 101 ASP C 1 102 LEU N 1 102 LEU CA 1 102 LEU C -81.00 -49.00 -66.03 -65.60 -68.48 . . 0 "[ .]"
67 . 1 102 LEU C 1 103 LEU N 1 103 LEU CA 1 103 LEU C -74.00 -58.00 -65.49 -75.19 -56.31 1.69 1 0 "[ .]"
68 . 1 103 LEU C 1 104 HIS N 1 104 HIS CA 1 104 HIS C -80.00 -52.00 -61.18 -66.62 -53.39 . . 0 "[ .]"
69 . 1 104 HIS C 1 105 ALA N 1 105 ALA CA 1 105 ALA C -131.00 -63.00 -91.86 -62.06 -76.22 0.99 3 0 "[ .]"
70 . 1 108 THR C 1 109 GLY N 1 109 GLY CA 1 109 GLY C 79.00 103.00 82.40 77.45 89.65 1.55 3 0 "[ .]"
71 . 1 109 GLY C 1 110 VAL N 1 110 VAL CA 1 110 VAL C 176.00 -48.00 -145.55 -143.63 -146.62 . . 0 "[ .]"
72 . 1 110 VAL C 1 111 LYS N 1 111 LYS CA 1 111 LYS C 175.00 -101.00 -98.49 -99.27 -97.88 3.12 5 0 "[ .]"
73 . 1 111 LYS C 1 112 ASP N 1 112 ASP CA 1 112 ASP C -177.00 -57.00 -106.87 -114.92 -99.44 . . 0 "[ .]"
74 . 1 112 ASP C 1 113 ILE N 1 113 ILE CA 1 113 ILE C -143.00 -59.00 -95.85 -102.70 -83.08 . . 0 "[ .]"
75 . 1 113 ILE C 1 114 VAL N 1 114 VAL CA 1 114 VAL C -96.00 -40.00 -99.32 -100.78 -97.74 4.78 5 0 "[ .]"
76 . 1 116 GLY C 1 117 TYR N 1 117 TYR CA 1 117 TYR C -68.00 -52.00 -54.31 -59.06 -51.77 0.23 1 0 "[ .]"
77 . 1 117 TYR C 1 118 SER N 1 118 SER CA 1 118 SER C -70.00 -58.00 -60.54 -71.52 -56.47 1.53 5 0 "[ .]"
78 . 1 118 SER C 1 119 ALA N 1 119 ALA CA 1 119 ALA C -71.95 -61.99 -70.21 -72.55 -74.22 2.27 1 0 "[ .]"
79 . 1 119 ALA C 1 120 TRP N 1 120 TRP CA 1 120 TRP C -71.00 -51.00 -58.77 -61.57 -53.92 . . 0 "[ .]"
80 . 1 120 TRP C 1 121 ALA N 1 121 ALA CA 1 121 ALA C -72.25 -54.05 -61.37 -56.84 -63.63 1.60 2 0 "[ .]"
81 . 1 121 ALA C 1 122 LYS N 1 122 LYS CA 1 122 LYS C -76.00 -56.00 -57.52 -60.70 -56.06 . . 0 "[ .]"
82 . 1 122 LYS C 1 123 ASN N 1 123 ASN CA 1 123 ASN C -124.00 -56.00 -71.87 -54.02 -63.36 1.98 2 0 "[ .]"
83 . 1 124 GLY C 1 125 LEU N 1 125 LEU CA 1 125 LEU C -122.00 -50.00 -121.44 -124.34 -126.43 4.83 5 0 "[ .]"
84 . 1 126 PRO C 1 127 THR N 1 127 THR CA 1 127 THR C -173.00 -85.00 -114.79 -92.96 -93.08 8.86 4 1 "[ +.]"
85 . 1 127 THR C 1 128 LYS N 1 128 LYS CA 1 128 LYS C 162.00 -70.00 -169.16 -175.48 -175.69 . . 0 "[ .]"
stop_
save_
Contact the webmaster for help, if required. Tuesday, June 18, 2024 2:06:09 PM GMT (wattos1)