NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
447305 |
2kph   |
15601 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2kph
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 186
_TA_constraint_stats_list.Viol_count 81
_TA_constraint_stats_list.Viol_total 751.55
_TA_constraint_stats_list.Viol_max 5.59
_TA_constraint_stats_list.Viol_rms 0.28
_TA_constraint_stats_list.Viol_average_all_restraints 0.04
_TA_constraint_stats_list.Viol_average_violations_only 0.93
_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 8 LEU C 1 9 SER N 1 9 SER CA 1 9 SER C -90.00 -30.00 -66.61 -44.36 -50.27 . . 0 "[ . 1]"
2 . 1 9 SER C 1 10 ILE N 1 10 ILE CA 1 10 ILE C -90.00 -30.00 -54.22 -45.86 -50.58 . . 0 "[ . 1]"
3 . 1 10 ILE C 1 11 ASN N 1 11 ASN CA 1 11 ASN C -90.00 -30.00 -53.31 -64.11 -45.22 . . 0 "[ . 1]"
4 . 1 11 ASN C 1 12 PHE N 1 12 PHE CA 1 12 PHE C -90.00 -30.00 -50.86 -56.99 -43.74 . . 0 "[ . 1]"
5 . 1 12 PHE C 1 13 GLY N 1 13 GLY CA 1 13 GLY C -90.00 -30.00 -68.48 -61.00 -67.28 . . 0 "[ . 1]"
6 . 1 13 GLY C 1 14 LYS N 1 14 LYS CA 1 14 LYS C -90.00 -30.00 -52.49 -47.79 -54.32 . . 0 "[ . 1]"
7 . 1 14 LYS C 1 15 ALA N 1 15 ALA CA 1 15 ALA C -90.00 -30.00 -58.31 -59.12 -66.42 . . 0 "[ . 1]"
8 . 1 15 ALA C 1 16 LEU N 1 16 LEU CA 1 16 LEU C -90.00 -30.00 -58.97 -67.48 -51.88 . . 0 "[ . 1]"
9 . 1 16 LEU C 1 17 ASP N 1 17 ASP CA 1 17 ASP C -90.00 -30.00 -59.27 -62.13 -63.27 . . 0 "[ . 1]"
10 . 1 17 ASP C 1 18 THR N 1 18 THR CA 1 18 THR C -90.00 -30.00 -50.95 -59.51 -43.68 . . 0 "[ . 1]"
11 . 1 18 THR C 1 19 CYS N 1 19 CYS CA 1 19 CYS C -90.00 -30.00 -60.19 -69.87 -52.03 . . 0 "[ . 1]"
12 . 1 19 CYS C 1 20 LYS N 1 20 LYS CA 1 20 LYS C -90.00 -30.00 -48.25 -57.36 -37.90 . . 0 "[ . 1]"
13 . 1 20 LYS C 1 21 LYS N 1 21 LYS CA 1 21 LYS C -90.00 -30.00 -70.07 -89.59 -56.28 . . 0 "[ . 1]"
14 . 1 21 LYS C 1 22 GLU N 1 22 GLU CA 1 22 GLU C -90.00 -30.00 -89.29 -90.76 -85.00 0.76 9 0 "[ . 1]"
15 . 1 27 ASP C 1 28 SER N 1 28 SER CA 1 28 SER C -90.00 -30.00 -43.37 -41.97 -43.87 . . 0 "[ . 1]"
16 . 1 28 SER C 1 29 ILE N 1 29 ILE CA 1 29 ILE C -90.00 -30.00 -76.61 -80.81 -69.54 . . 0 "[ . 1]"
17 . 1 29 ILE C 1 30 ASN N 1 30 ASN CA 1 30 ASN C -90.00 -30.00 -57.97 -66.51 -49.71 . . 0 "[ . 1]"
18 . 1 30 ASN C 1 31 GLU N 1 31 GLU CA 1 31 GLU C -90.00 -30.00 -66.22 -65.07 -68.08 . . 0 "[ . 1]"
19 . 1 31 GLU C 1 32 ASP N 1 32 ASP CA 1 32 ASP C -90.00 -30.00 -57.27 -66.78 -47.81 . . 0 "[ . 1]"
20 . 1 32 ASP C 1 33 PHE N 1 33 PHE CA 1 33 PHE C -90.00 -30.00 -63.79 -74.56 -53.15 . . 0 "[ . 1]"
21 . 1 33 PHE C 1 34 TYR N 1 34 TYR CA 1 34 TYR C -90.00 -30.00 -64.82 -79.72 -43.60 . . 0 "[ . 1]"
22 . 1 34 TYR C 1 35 LYS N 1 35 LYS CA 1 35 LYS C -90.00 -30.00 -65.90 -74.50 -57.14 . . 0 "[ . 1]"
23 . 1 35 LYS C 1 36 PHE N 1 36 PHE CA 1 36 PHE C -90.00 -30.00 -53.83 -44.67 -46.03 . . 0 "[ . 1]"
24 . 1 45 ASN C 1 46 ARG N 1 46 ARG CA 1 46 ARG C -90.00 -30.00 -51.96 -40.20 -43.35 0.43 8 0 "[ . 1]"
25 . 1 46 ARG C 1 47 LEU N 1 47 LEU CA 1 47 LEU C -90.00 -30.00 -58.75 -54.43 -62.06 . . 0 "[ . 1]"
26 . 1 47 LEU C 1 48 THR N 1 48 THR CA 1 48 THR C -90.00 -30.00 -45.76 -44.65 -45.54 . . 0 "[ . 1]"
27 . 1 48 THR C 1 49 GLY N 1 49 GLY CA 1 49 GLY C -90.00 -30.00 -74.79 -82.63 -63.97 . . 0 "[ . 1]"
28 . 1 49 GLY C 1 50 CYS N 1 50 CYS CA 1 50 CYS C -90.00 -30.00 -51.83 -45.26 -48.66 . . 0 "[ . 1]"
29 . 1 50 CYS C 1 51 ALA N 1 51 ALA CA 1 51 ALA C -90.00 -30.00 -56.66 -68.48 -42.23 . . 0 "[ . 1]"
30 . 1 51 ALA C 1 52 ILE N 1 52 ILE CA 1 52 ILE C -90.00 -30.00 -46.03 -48.47 -43.61 . . 0 "[ . 1]"
31 . 1 52 ILE C 1 53 LYS N 1 53 LYS CA 1 53 LYS C -90.00 -30.00 -63.89 -63.01 -65.39 . . 0 "[ . 1]"
32 . 1 53 LYS C 1 54 CYS N 1 54 CYS CA 1 54 CYS C -90.00 -30.00 -49.22 -62.91 -44.44 . . 0 "[ . 1]"
33 . 1 54 CYS C 1 55 LEU N 1 55 LEU CA 1 55 LEU C -90.00 -30.00 -52.42 -51.10 -54.10 . . 0 "[ . 1]"
34 . 1 55 LEU C 1 56 SER N 1 56 SER CA 1 56 SER C -90.00 -30.00 -53.59 -75.38 -43.36 . . 0 "[ . 1]"
35 . 1 56 SER C 1 57 GLU N 1 57 GLU CA 1 57 GLU C -90.00 -30.00 -66.70 -82.86 -49.95 . . 0 "[ . 1]"
36 . 1 57 GLU C 1 58 LYS N 1 58 LYS CA 1 58 LYS C -90.00 -30.00 -88.46 -90.69 -79.37 0.69 4 0 "[ . 1]"
37 . 1 58 LYS C 1 59 LEU N 1 59 LEU CA 1 59 LEU C -90.00 -30.00 -33.54 -40.93 -29.75 0.25 1 0 "[ . 1]"
38 . 1 59 LEU C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -90.00 -30.00 -61.76 -57.32 -58.31 . . 0 "[ . 1]"
39 . 1 60 GLU C 1 61 MET N 1 61 MET CA 1 61 MET C -90.00 -30.00 -84.71 -76.12 -80.96 1.50 7 0 "[ . 1]"
40 . 1 61 MET C 1 62 VAL N 1 62 VAL CA 1 62 VAL C -90.00 -30.00 -54.18 -61.33 -67.12 . . 0 "[ . 1]"
41 . 1 68 LEU C 1 69 HIS N 1 69 HIS CA 1 69 HIS C -150.00 -90.00 -145.04 -147.85 -149.18 1.06 4 0 "[ . 1]"
42 . 1 71 GLY C 1 72 ASN N 1 72 ASN CA 1 72 ASN C -150.00 -90.00 -148.31 -150.64 -137.23 0.64 2 0 "[ . 1]"
43 . 1 73 ALA C 1 74 ARG N 1 74 ARG CA 1 74 ARG C -90.00 -30.00 -44.26 -56.91 -35.67 . . 0 "[ . 1]"
44 . 1 74 ARG C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -90.00 -30.00 -58.02 -50.15 -66.76 . . 0 "[ . 1]"
45 . 1 75 GLU C 1 76 PHE N 1 76 PHE CA 1 76 PHE C -90.00 -30.00 -68.41 -62.55 -67.97 . . 0 "[ . 1]"
46 . 1 76 PHE C 1 77 ALA N 1 77 ALA CA 1 77 ALA C -90.00 -30.00 -86.03 -63.12 -78.81 0.63 8 0 "[ . 1]"
47 . 1 77 ALA C 1 78 MET N 1 78 MET CA 1 78 MET C -90.00 -30.00 -71.18 -73.98 -78.73 . . 0 "[ . 1]"
48 . 1 83 ASP C 1 84 ASP N 1 84 ASP CA 1 84 ASP C -90.00 -30.00 -53.64 -41.39 -44.15 . . 0 "[ . 1]"
49 . 1 84 ASP C 1 85 ALA N 1 85 ALA CA 1 85 ALA C -90.00 -30.00 -43.98 -49.45 -42.01 . . 0 "[ . 1]"
50 . 1 85 ALA C 1 86 MET N 1 86 MET CA 1 86 MET C -90.00 -30.00 -53.22 -57.69 -62.25 . . 0 "[ . 1]"
51 . 1 86 MET C 1 87 ALA N 1 87 ALA CA 1 87 ALA C -90.00 -30.00 -42.40 -52.50 -36.77 . . 0 "[ . 1]"
52 . 1 87 ALA C 1 88 LYS N 1 88 LYS CA 1 88 LYS C -90.00 -30.00 -54.77 -53.95 -57.86 . . 0 "[ . 1]"
53 . 1 88 LYS C 1 89 GLN N 1 89 GLN CA 1 89 GLN C -90.00 -30.00 -57.88 -60.91 -64.08 . . 0 "[ . 1]"
54 . 1 89 GLN C 1 90 LEU N 1 90 LEU CA 1 90 LEU C -90.00 -30.00 -54.82 -50.21 -55.11 . . 0 "[ . 1]"
55 . 1 90 LEU C 1 91 VAL N 1 91 VAL CA 1 91 VAL C -90.00 -30.00 -69.18 -70.07 -70.20 . . 0 "[ . 1]"
56 . 1 91 VAL C 1 92 ASP N 1 92 ASP CA 1 92 ASP C -90.00 -30.00 -63.06 -61.87 -62.66 . . 0 "[ . 1]"
57 . 1 92 ASP C 1 93 LEU N 1 93 LEU CA 1 93 LEU C -90.00 -30.00 -87.67 -88.27 -89.01 . . 0 "[ . 1]"
58 . 1 93 LEU C 1 94 ILE N 1 94 ILE CA 1 94 ILE C -90.00 -30.00 -53.41 -62.30 -45.11 . . 0 "[ . 1]"
59 . 1 94 ILE C 1 95 HIS N 1 95 HIS CA 1 95 HIS C -90.00 -30.00 -74.90 -79.37 -68.42 . . 0 "[ . 1]"
60 . 1 95 HIS C 1 96 GLY N 1 96 GLY CA 1 96 GLY C -90.00 -30.00 -50.49 -48.25 -50.12 . . 0 "[ . 1]"
61 . 1 96 GLY C 1 97 CYS N 1 97 CYS CA 1 97 CYS C -90.00 -30.00 -60.43 -67.37 -54.01 . . 0 "[ . 1]"
62 . 1 97 CYS C 1 98 GLU N 1 98 GLU CA 1 98 GLU C -90.00 -30.00 -59.01 -51.23 -55.30 . . 0 "[ . 1]"
63 . 1 98 GLU C 1 99 LYS N 1 99 LYS CA 1 99 LYS C -90.00 -30.00 -80.09 -90.21 -66.41 0.21 2 0 "[ . 1]"
64 . 1 99 LYS C 1 100 SER N 1 100 SER CA 1 100 SER C -90.00 -30.00 -88.79 -92.88 -83.14 2.88 2 0 "[ . 1]"
65 . 1 106 ASP C 1 107 ARG N 1 107 ARG CA 1 107 ARG C -90.00 -30.00 -69.85 -89.16 -32.69 . . 0 "[ . 1]"
66 . 1 107 ARG C 1 108 CYS N 1 108 CYS CA 1 108 CYS C -90.00 -30.00 -54.94 -54.43 -57.82 . . 0 "[ . 1]"
67 . 1 108 CYS C 1 109 MET N 1 109 MET CA 1 109 MET C -90.00 -30.00 -76.51 -82.17 -72.51 . . 0 "[ . 1]"
68 . 1 109 MET C 1 110 GLU N 1 110 GLU CA 1 110 GLU C -90.00 -30.00 -62.17 -66.25 -66.90 . . 0 "[ . 1]"
69 . 1 110 GLU C 1 111 VAL N 1 111 VAL CA 1 111 VAL C -90.00 -30.00 -64.17 -81.08 -43.59 . . 0 "[ . 1]"
70 . 1 111 VAL C 1 112 LEU N 1 112 LEU CA 1 112 LEU C -90.00 -30.00 -71.18 -74.82 -77.32 . . 0 "[ . 1]"
71 . 1 112 LEU C 1 113 SER N 1 113 SER CA 1 113 SER C -90.00 -30.00 -68.33 -79.80 -57.15 . . 0 "[ . 1]"
72 . 1 113 SER C 1 114 ILE N 1 114 ILE CA 1 114 ILE C -90.00 -30.00 -61.82 -60.27 -65.29 . . 0 "[ . 1]"
73 . 1 114 ILE C 1 115 ALA N 1 115 ALA CA 1 115 ALA C -90.00 -30.00 -56.79 -74.09 -46.26 . . 0 "[ . 1]"
74 . 1 115 ALA C 1 116 MET N 1 116 MET CA 1 116 MET C -90.00 -30.00 -63.17 -60.82 -61.90 . . 0 "[ . 1]"
75 . 1 116 MET C 1 117 CYS N 1 117 CYS CA 1 117 CYS C -90.00 -30.00 -73.93 -72.18 -74.44 . . 0 "[ . 1]"
76 . 1 117 CYS C 1 118 PHE N 1 118 PHE CA 1 118 PHE C -90.00 -30.00 -44.38 -56.18 -39.45 . . 0 "[ . 1]"
77 . 1 118 PHE C 1 119 LYS N 1 119 LYS CA 1 119 LYS C -90.00 -30.00 -68.82 -68.32 -72.10 . . 0 "[ . 1]"
78 . 1 119 LYS C 1 120 LYS N 1 120 LYS CA 1 120 LYS C -90.00 -30.00 -56.29 -68.14 -41.94 . . 0 "[ . 1]"
79 . 1 120 LYS C 1 121 GLU N 1 121 GLU CA 1 121 GLU C -90.00 -30.00 -51.52 -51.19 -53.10 . . 0 "[ . 1]"
80 . 1 121 GLU C 1 122 ILE N 1 122 ILE CA 1 122 ILE C -90.00 -30.00 -51.49 -43.13 -46.46 . . 0 "[ . 1]"
81 . 1 122 ILE C 1 123 HIS N 1 123 HIS CA 1 123 HIS C -90.00 -30.00 -58.26 -49.22 -63.37 . . 0 "[ . 1]"
82 . 1 123 HIS C 1 124 ASN N 1 124 ASN CA 1 124 ASN C -90.00 -30.00 -77.74 -78.61 -87.15 0.20 1 0 "[ . 1]"
83 . 1 124 ASN C 1 125 LEU N 1 125 LEU CA 1 125 LEU C -90.00 -30.00 -62.46 -53.14 -59.34 . . 0 "[ . 1]"
84 . 1 130 ASN C 1 131 MET N 1 131 MET CA 1 131 MET C -90.00 -30.00 -59.77 -88.57 -40.47 . . 0 "[ . 1]"
85 . 1 131 MET C 1 132 GLU N 1 132 GLU CA 1 132 GLU C -90.00 -30.00 -48.71 -43.89 -65.61 . . 0 "[ . 1]"
86 . 1 132 GLU C 1 133 VAL N 1 133 VAL CA 1 133 VAL C -90.00 -30.00 -49.86 -47.27 -47.97 . . 0 "[ . 1]"
87 . 1 133 VAL C 1 134 VAL N 1 134 VAL CA 1 134 VAL C -90.00 -30.00 -41.54 -44.21 -48.77 . . 0 "[ . 1]"
88 . 1 134 VAL C 1 135 VAL N 1 135 VAL CA 1 135 VAL C -90.00 -30.00 -56.59 -56.89 -60.06 . . 0 "[ . 1]"
89 . 1 135 VAL C 1 136 GLY N 1 136 GLY CA 1 136 GLY C -90.00 -30.00 -47.71 -42.98 -45.19 . . 0 "[ . 1]"
90 . 1 136 GLY C 1 137 GLU N 1 137 GLU CA 1 137 GLU C -90.00 -30.00 -66.71 -73.87 -76.41 . . 0 "[ . 1]"
91 . 1 137 GLU C 1 138 VAL N 1 138 VAL CA 1 138 VAL C -90.00 -30.00 -50.47 -49.50 -52.28 . . 0 "[ . 1]"
92 . 1 138 VAL C 1 139 LEU N 1 139 LEU CA 1 139 LEU C -90.00 -30.00 -71.35 -63.58 -67.56 . . 0 "[ . 1]"
93 . 1 139 LEU C 1 140 ALA N 1 140 ALA CA 1 140 ALA C -90.00 -30.00 -54.70 -41.70 -48.43 . . 0 "[ . 1]"
94 . 1 140 ALA C 1 141 GLU N 1 141 GLU CA 1 141 GLU C -90.00 -30.00 -60.38 -43.55 -47.54 . . 0 "[ . 1]"
95 . 1 9 SER N 1 9 SER CA 1 9 SER C 1 10 ILE N -90.00 10.00 -58.31 -85.40 -38.18 . . 0 "[ . 1]"
96 . 1 10 ILE N 1 10 ILE CA 1 10 ILE C 1 11 ASN N -70.00 -10.00 -45.45 -47.87 -52.78 . . 0 "[ . 1]"
97 . 1 11 ASN N 1 11 ASN CA 1 11 ASN C 1 12 PHE N -70.00 -10.00 -64.55 -70.60 -47.83 0.60 6 0 "[ . 1]"
98 . 1 12 PHE N 1 12 PHE CA 1 12 PHE C 1 13 GLY N -70.00 -10.00 -29.12 -42.72 -19.63 . . 0 "[ . 1]"
99 . 1 13 GLY N 1 13 GLY CA 1 13 GLY C 1 14 LYS N -70.00 -10.00 -45.04 -50.82 -56.49 . . 0 "[ . 1]"
100 . 1 14 LYS N 1 14 LYS CA 1 14 LYS C 1 15 ALA N -70.00 -10.00 -50.86 -63.23 -37.15 . . 0 "[ . 1]"
101 . 1 15 ALA N 1 15 ALA CA 1 15 ALA C 1 16 LEU N -70.00 -10.00 -51.17 -61.36 -43.86 . . 0 "[ . 1]"
102 . 1 16 LEU N 1 16 LEU CA 1 16 LEU C 1 17 ASP N -70.00 -10.00 -41.31 -54.30 -37.13 . . 0 "[ . 1]"
103 . 1 17 ASP N 1 17 ASP CA 1 17 ASP C 1 18 THR N -70.00 -10.00 -49.54 -46.74 -50.93 . . 0 "[ . 1]"
104 . 1 18 THR N 1 18 THR CA 1 18 THR C 1 19 CYS N -70.00 -10.00 -47.03 -54.47 -38.26 . . 0 "[ . 1]"
105 . 1 19 CYS N 1 19 CYS CA 1 19 CYS C 1 20 LYS N -70.00 -10.00 -51.76 -55.72 -59.46 . . 0 "[ . 1]"
106 . 1 20 LYS N 1 20 LYS CA 1 20 LYS C 1 21 LYS N -70.00 -10.00 -37.50 -28.95 -35.35 . . 0 "[ . 1]"
107 . 1 21 LYS N 1 21 LYS CA 1 21 LYS C 1 22 GLU N -70.00 -10.00 -32.57 -31.76 -36.89 . . 0 "[ . 1]"
108 . 1 22 GLU N 1 22 GLU CA 1 22 GLU C 1 23 LEU N -90.00 10.00 -36.72 -53.74 -20.18 . . 0 "[ . 1]"
109 . 1 28 SER N 1 28 SER CA 1 28 SER C 1 29 ILE N -90.00 10.00 -39.12 -56.93 -31.23 . . 0 "[ . 1]"
110 . 1 29 ILE N 1 29 ILE CA 1 29 ILE C 1 30 ASN N -70.00 -10.00 -35.26 -31.39 -33.92 . . 0 "[ . 1]"
111 . 1 30 ASN N 1 30 ASN CA 1 30 ASN C 1 31 GLU N -70.00 -10.00 -42.02 -38.87 -40.06 . . 0 "[ . 1]"
112 . 1 31 GLU N 1 31 GLU CA 1 31 GLU C 1 32 ASP N -70.00 -10.00 -55.73 -60.75 -46.05 . . 0 "[ . 1]"
113 . 1 32 ASP N 1 32 ASP CA 1 32 ASP C 1 33 PHE N -70.00 -10.00 -35.92 -44.41 -24.50 . . 0 "[ . 1]"
114 . 1 33 PHE N 1 33 PHE CA 1 33 PHE C 1 34 TYR N -70.00 -10.00 -37.12 -25.78 -34.88 . . 0 "[ . 1]"
115 . 1 34 TYR N 1 34 TYR CA 1 34 TYR C 1 35 LYS N -70.00 -10.00 -42.73 -53.35 -30.11 . . 0 "[ . 1]"
116 . 1 35 LYS N 1 35 LYS CA 1 35 LYS C 1 36 PHE N -70.00 -10.00 -28.85 -30.95 -38.64 . . 0 "[ . 1]"
117 . 1 36 PHE N 1 36 PHE CA 1 36 PHE C 1 37 TRP N -90.00 10.00 -44.99 -47.38 -52.62 . . 0 "[ . 1]"
118 . 1 46 ARG N 1 46 ARG CA 1 46 ARG C 1 47 LEU N -90.00 10.00 -37.85 -66.96 -10.45 . . 0 "[ . 1]"
119 . 1 47 LEU N 1 47 LEU CA 1 47 LEU C 1 48 THR N -70.00 -10.00 -56.52 -64.10 -64.37 . . 0 "[ . 1]"
120 . 1 48 THR N 1 48 THR CA 1 48 THR C 1 49 GLY N -70.00 -10.00 -25.68 -20.13 -22.24 . . 0 "[ . 1]"
121 . 1 49 GLY N 1 49 GLY CA 1 49 GLY C 1 50 CYS N -70.00 -10.00 -56.16 -69.27 -48.94 . . 0 "[ . 1]"
122 . 1 50 CYS N 1 50 CYS CA 1 50 CYS C 1 51 ALA N -70.00 -10.00 -35.34 -30.20 -31.48 . . 0 "[ . 1]"
123 . 1 51 ALA N 1 51 ALA CA 1 51 ALA C 1 52 ILE N -70.00 -10.00 -55.77 -51.34 -56.45 . . 0 "[ . 1]"
124 . 1 52 ILE N 1 52 ILE CA 1 52 ILE C 1 53 LYS N -70.00 -10.00 -40.55 -39.41 -40.54 . . 0 "[ . 1]"
125 . 1 53 LYS N 1 53 LYS CA 1 53 LYS C 1 54 CYS N -70.00 -10.00 -54.85 -48.54 -51.13 . . 0 "[ . 1]"
126 . 1 54 CYS N 1 54 CYS CA 1 54 CYS C 1 55 LEU N -70.00 -10.00 -47.78 -59.14 -34.86 . . 0 "[ . 1]"
127 . 1 55 LEU N 1 55 LEU CA 1 55 LEU C 1 56 SER N -90.00 10.00 -44.10 -46.50 -46.88 . . 0 "[ . 1]"
128 . 1 56 SER N 1 56 SER CA 1 56 SER C 1 57 GLU N -70.00 -10.00 -47.30 -44.84 -47.94 . . 0 "[ . 1]"
129 . 1 57 GLU N 1 57 GLU CA 1 57 GLU C 1 58 LYS N -70.00 -10.00 -20.20 -12.99 -20.81 0.60 5 0 "[ . 1]"
130 . 1 58 LYS N 1 58 LYS CA 1 58 LYS C 1 59 LEU N -70.00 -10.00 -7.92 -9.04 -7.21 2.79 10 0 "[ . 1]"
131 . 1 59 LEU N 1 59 LEU CA 1 59 LEU C 1 60 GLU N -90.00 10.00 -31.44 -35.57 -35.83 . . 0 "[ . 1]"
132 . 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 MET N -70.00 -10.00 -37.36 -43.90 -29.68 . . 0 "[ . 1]"
133 . 1 61 MET N 1 61 MET CA 1 61 MET C 1 62 VAL N -70.00 -10.00 -30.27 -36.56 -11.38 . . 0 "[ . 1]"
134 . 1 62 VAL N 1 62 VAL CA 1 62 VAL C 1 63 ASP N -90.00 10.00 -76.58 -86.12 -87.80 0.36 7 0 "[ . 1]"
135 . 1 69 HIS N 1 69 HIS CA 1 69 HIS C 1 70 HIS N 100.00 160.00 154.44 141.99 160.58 0.58 4 0 "[ . 1]"
136 . 1 72 ASN N 1 72 ASN CA 1 72 ASN C 1 73 ALA N 100.00 160.00 100.39 107.85 102.13 1.52 8 0 "[ . 1]"
137 . 1 74 ARG N 1 74 ARG CA 1 74 ARG C 1 75 GLU N -90.00 10.00 -62.98 -87.92 -37.76 . . 0 "[ . 1]"
138 . 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 PHE N -70.00 -10.00 -44.04 -58.80 -30.90 . . 0 "[ . 1]"
139 . 1 76 PHE N 1 76 PHE CA 1 76 PHE C 1 77 ALA N -70.00 -10.00 -29.41 -54.39 -18.54 . . 0 "[ . 1]"
140 . 1 77 ALA N 1 77 ALA CA 1 77 ALA C 1 78 MET N -70.00 -10.00 -32.24 -50.41 -15.50 . . 0 "[ . 1]"
141 . 1 78 MET N 1 78 MET CA 1 78 MET C 1 79 LYS N -90.00 10.00 -31.26 -48.73 10.81 0.81 6 0 "[ . 1]"
142 . 1 84 ASP N 1 84 ASP CA 1 84 ASP C 1 85 ALA N -90.00 10.00 -79.70 -72.66 -78.57 0.12 5 0 "[ . 1]"
143 . 1 85 ALA N 1 85 ALA CA 1 85 ALA C 1 86 MET N -70.00 -10.00 -50.86 -67.44 -33.68 . . 0 "[ . 1]"
144 . 1 86 MET N 1 86 MET CA 1 86 MET C 1 87 ALA N -70.00 -10.00 -64.74 -59.86 -65.59 1.02 5 0 "[ . 1]"
145 . 1 87 ALA N 1 87 ALA CA 1 87 ALA C 1 88 LYS N -70.00 -10.00 -52.48 -64.27 -41.79 . . 0 "[ . 1]"
146 . 1 88 LYS N 1 88 LYS CA 1 88 LYS C 1 89 GLN N -70.00 -10.00 -50.84 -44.35 -46.49 . . 0 "[ . 1]"
147 . 1 89 GLN N 1 89 GLN CA 1 89 GLN C 1 90 LEU N -70.00 -10.00 -46.09 -55.75 -33.31 . . 0 "[ . 1]"
148 . 1 90 LEU N 1 90 LEU CA 1 90 LEU C 1 91 VAL N -70.00 -10.00 -44.45 -40.86 -45.12 . . 0 "[ . 1]"
149 . 1 91 VAL N 1 91 VAL CA 1 91 VAL C 1 92 ASP N -70.00 -10.00 -43.89 -54.54 -29.11 . . 0 "[ . 1]"
150 . 1 92 ASP N 1 92 ASP CA 1 92 ASP C 1 93 LEU N -70.00 -10.00 -21.76 -19.36 -20.91 . . 0 "[ . 1]"
151 . 1 93 LEU N 1 93 LEU CA 1 93 LEU C 1 94 ILE N -70.00 -10.00 -53.18 -50.62 -53.53 . . 0 "[ . 1]"
152 . 1 94 ILE N 1 94 ILE CA 1 94 ILE C 1 95 HIS N -70.00 -10.00 -36.20 -35.48 -38.24 . . 0 "[ . 1]"
153 . 1 95 HIS N 1 95 HIS CA 1 95 HIS C 1 96 GLY N -70.00 -10.00 -41.11 -50.91 -36.19 . . 0 "[ . 1]"
154 . 1 96 GLY N 1 96 GLY CA 1 96 GLY C 1 97 CYS N -70.00 -10.00 -44.11 -52.02 -35.62 . . 0 "[ . 1]"
155 . 1 97 CYS N 1 97 CYS CA 1 97 CYS C 1 98 GLU N -70.00 -10.00 -43.15 -53.22 -31.51 . . 0 "[ . 1]"
156 . 1 99 LYS N 1 99 LYS CA 1 99 LYS C 1 100 SER N -70.00 -10.00 -8.51 -9.79 -11.01 5.59 9 1 "[ . +1]"
157 . 1 100 SER N 1 100 SER CA 1 100 SER C 1 101 ILE N -90.00 10.00 -43.47 -22.11 -33.71 . . 0 "[ . 1]"
158 . 1 107 ARG N 1 107 ARG CA 1 107 ARG C 1 108 CYS N -90.00 10.00 -48.87 -40.02 -44.93 . . 0 "[ . 1]"
159 . 1 108 CYS N 1 108 CYS CA 1 108 CYS C 1 109 MET N -70.00 -10.00 -36.52 -40.41 -43.36 . . 0 "[ . 1]"
160 . 1 109 MET N 1 109 MET CA 1 109 MET C 1 110 GLU N -70.00 -10.00 -44.46 -39.94 -40.11 . . 0 "[ . 1]"
161 . 1 110 GLU N 1 110 GLU CA 1 110 GLU C 1 111 VAL N -70.00 -10.00 -46.49 -38.14 -42.51 . . 0 "[ . 1]"
162 . 1 111 VAL N 1 111 VAL CA 1 111 VAL C 1 112 LEU N -70.00 -10.00 -30.97 -44.51 -22.79 . . 0 "[ . 1]"
163 . 1 112 LEU N 1 112 LEU CA 1 112 LEU C 1 113 SER N -70.00 -10.00 -38.84 -43.46 -53.24 . . 0 "[ . 1]"
164 . 1 113 SER N 1 113 SER CA 1 113 SER C 1 114 ILE N -70.00 -10.00 -40.35 -51.65 -29.07 . . 0 "[ . 1]"
165 . 1 114 ILE N 1 114 ILE CA 1 114 ILE C 1 115 ALA N -70.00 -10.00 -44.96 -57.39 -30.77 . . 0 "[ . 1]"
166 . 1 115 ALA N 1 115 ALA CA 1 115 ALA C 1 116 MET N -70.00 -10.00 -47.75 -54.67 -41.47 . . 0 "[ . 1]"
167 . 1 116 MET N 1 116 MET CA 1 116 MET C 1 117 CYS N -70.00 -10.00 -35.75 -44.96 -20.05 . . 0 "[ . 1]"
168 . 1 117 CYS N 1 117 CYS CA 1 117 CYS C 1 118 PHE N -70.00 -10.00 -56.90 -53.70 -58.36 . . 0 "[ . 1]"
169 . 1 118 PHE N 1 118 PHE CA 1 118 PHE C 1 119 LYS N -70.00 -10.00 -43.94 -54.95 -32.62 . . 0 "[ . 1]"
170 . 1 119 LYS N 1 119 LYS CA 1 119 LYS C 1 120 LYS N -70.00 -10.00 -45.36 -41.97 -44.22 . . 0 "[ . 1]"
171 . 1 120 LYS N 1 120 LYS CA 1 120 LYS C 1 121 GLU N -70.00 -10.00 -58.78 -69.98 -54.07 . . 0 "[ . 1]"
172 . 1 121 GLU N 1 121 GLU CA 1 121 GLU C 1 122 ILE N -70.00 -10.00 -47.94 -55.80 -57.29 . . 0 "[ . 1]"
173 . 1 122 ILE N 1 122 ILE CA 1 122 ILE C 1 123 HIS N -70.00 -10.00 -48.95 -67.07 -30.36 . . 0 "[ . 1]"
174 . 1 123 HIS N 1 123 HIS CA 1 123 HIS C 1 124 ASN N -70.00 -10.00 -31.74 -36.23 -37.44 . . 0 "[ . 1]"
175 . 1 124 ASN N 1 124 ASN CA 1 124 ASN C 1 125 LEU N -70.00 -10.00 -25.32 -41.66 -10.48 . . 0 "[ . 1]"
176 . 1 131 MET N 1 131 MET CA 1 131 MET C 1 132 GLU N -90.00 10.00 -48.53 -66.91 -19.04 . . 0 "[ . 1]"
177 . 1 132 GLU N 1 132 GLU CA 1 132 GLU C 1 133 VAL N -70.00 -10.00 -63.21 -64.36 -66.45 0.27 9 0 "[ . 1]"
178 . 1 133 VAL N 1 133 VAL CA 1 133 VAL C 1 134 VAL N -70.00 -10.00 -60.32 -64.84 -47.47 . . 0 "[ . 1]"
179 . 1 134 VAL N 1 134 VAL CA 1 134 VAL C 1 135 VAL N -70.00 -10.00 -53.24 -69.46 -44.34 . . 0 "[ . 1]"
180 . 1 135 VAL N 1 135 VAL CA 1 135 VAL C 1 136 GLY N -70.00 -10.00 -62.81 -69.18 -51.73 . . 0 "[ . 1]"
181 . 1 136 GLY N 1 136 GLY CA 1 136 GLY C 1 137 GLU N -70.00 -10.00 -26.58 -48.41 -11.06 . . 0 "[ . 1]"
182 . 1 137 GLU N 1 137 GLU CA 1 137 GLU C 1 138 VAL N -70.00 -10.00 -63.46 -62.38 -64.18 . . 0 "[ . 1]"
183 . 1 138 VAL N 1 138 VAL CA 1 138 VAL C 1 139 LEU N -70.00 -10.00 -33.19 -39.40 -20.08 . . 0 "[ . 1]"
184 . 1 139 LEU N 1 139 LEU CA 1 139 LEU C 1 140 ALA N -70.00 -10.00 -54.49 -65.81 -42.41 . . 0 "[ . 1]"
185 . 1 140 ALA N 1 140 ALA CA 1 140 ALA C 1 141 GLU N -70.00 -10.00 -23.13 -40.99 -10.45 . . 0 "[ . 1]"
186 . 1 141 GLU N 1 141 GLU CA 1 141 GLU C 1 142 VAL N -90.00 10.00 -74.58 -84.05 -53.39 . . 0 "[ . 1]"
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