NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
450422 |
2rlo   |
cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2rlo
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 160
_TA_constraint_stats_list.Viol_count 671
_TA_constraint_stats_list.Viol_total 4488.78
_TA_constraint_stats_list.Viol_max 2.00
_TA_constraint_stats_list.Viol_rms 0.21
_TA_constraint_stats_list.Viol_average_all_restraints 0.07
_TA_constraint_stats_list.Viol_average_violations_only 0.33
_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 1 ARG C 1 2 ALA N 1 2 ALA CA 1 2 ALA C -120.56 -45.56 -101.91 -100.95 -107.69 0.08 10 0 "[ . 1 . 2]"
2 . 1 2 ALA C 1 3 ILE N 1 3 ILE CA 1 3 ILE C -152.75 -67.75 -126.07 -136.74 -112.77 . . 0 "[ . 1 . 2]"
3 . 1 3 ILE C 1 4 PRO N 1 4 PRO CA 1 4 PRO C -71.95 -48.75 -61.74 -56.88 -58.72 . . 0 "[ . 1 . 2]"
4 . 1 5 ILE C 1 6 LYS N 1 6 LYS CA 1 6 LYS C 159.74 -84.26 179.20 173.32 -174.10 . . 0 "[ . 1 . 2]"
5 . 1 6 LYS C 1 7 GLN N 1 7 GLN CA 1 7 GLN C -169.96 -107.56 -129.38 -128.43 -129.07 . . 0 "[ . 1 . 2]"
6 . 1 7 GLN C 1 8 SER N 1 8 SER CA 1 8 SER C 174.22 -91.18 -165.78 -160.70 -162.15 . . 0 "[ . 1 . 2]"
7 . 1 8 SER C 1 9 PHE N 1 9 PHE CA 1 9 PHE C -179.87 -67.87 -83.88 -93.72 -79.13 . . 0 "[ . 1 . 2]"
8 . 1 9 PHE C 1 10 LEU N 1 10 LEU CA 1 10 LEU C -172.10 -107.10 -128.52 -115.62 -120.49 . . 0 "[ . 1 . 2]"
9 . 1 10 LEU C 1 11 LEU N 1 11 LEU CA 1 11 LEU C -156.60 -56.60 -91.17 -98.66 -81.90 . . 0 "[ . 1 . 2]"
10 . 1 11 LEU C 1 12 LYS N 1 12 LYS CA 1 12 LYS C -163.12 -63.12 -125.28 -136.50 -112.36 . . 0 "[ . 1 . 2]"
11 . 1 12 LYS C 1 13 ARG N 1 13 ARG CA 1 13 ARG C -97.62 -47.62 -56.08 -63.14 -47.46 0.16 17 0 "[ . 1 . 2]"
12 . 1 16 ASN C 1 17 SER N 1 17 SER CA 1 17 SER C -86.56 -43.16 -76.35 -86.67 -59.56 0.11 19 0 "[ . 1 . 2]"
13 . 1 17 SER C 1 18 LEU N 1 18 LEU CA 1 18 LEU C -95.74 -41.74 -63.32 -76.54 -53.20 . . 0 "[ . 1 . 2]"
14 . 1 21 GLU C 1 22 TRP N 1 22 TRP CA 1 22 TRP C -133.83 -77.83 -96.26 -90.22 -92.98 . . 0 "[ . 1 . 2]"
15 . 1 22 TRP C 1 23 LYS N 1 23 LYS CA 1 23 LYS C -146.39 -97.59 -113.01 -122.28 -97.60 . . 0 "[ . 1 . 2]"
16 . 1 23 LYS C 1 24 LYS N 1 24 LYS CA 1 24 LYS C -119.15 -63.15 -64.77 -68.67 -70.46 0.29 12 0 "[ . 1 . 2]"
17 . 1 24 LYS C 1 25 LYS N 1 25 LYS CA 1 25 LYS C -154.00 -87.40 -121.77 -129.34 -108.13 . . 0 "[ . 1 . 2]"
18 . 1 26 TYR C 1 27 VAL N 1 27 VAL CA 1 27 VAL C -163.20 -63.20 -123.21 -115.44 -116.02 . . 0 "[ . 1 . 2]"
19 . 1 27 VAL C 1 28 THR N 1 28 THR CA 1 28 THR C -138.25 -106.85 -138.74 -138.89 -138.57 0.64 4 0 "[ . 1 . 2]"
20 . 1 28 THR C 1 29 LEU N 1 29 LEU CA 1 29 LEU C -141.46 -89.46 -90.76 -90.30 -90.74 0.63 8 0 "[ . 1 . 2]"
21 . 1 29 LEU C 1 30 SER N 1 30 SER CA 1 30 SER C -129.21 -53.21 -104.43 -108.98 -100.19 . . 0 "[ . 1 . 2]"
22 . 1 31 SER C 1 32 ASN N 1 32 ASN CA 1 32 ASN C -118.28 -68.68 -90.85 -91.75 -92.75 . . 0 "[ . 1 . 2]"
23 . 1 33 GLY C 1 34 PHE N 1 34 PHE CA 1 34 PHE C -162.40 -89.40 -138.73 -139.85 -137.08 . . 0 "[ . 1 . 2]"
24 . 1 34 PHE C 1 35 LEU N 1 35 LEU CA 1 35 LEU C -159.70 -93.70 -107.52 -109.48 -112.60 . . 0 "[ . 1 . 2]"
25 . 1 35 LEU C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -164.50 -112.50 -114.18 -114.26 -115.48 0.20 18 0 "[ . 1 . 2]"
26 . 1 36 LEU C 1 37 TYR N 1 37 TYR CA 1 37 TYR C -172.55 -92.55 -152.72 -148.98 -149.30 . . 0 "[ . 1 . 2]"
27 . 1 37 TYR C 1 38 HIS N 1 38 HIS CA 1 38 HIS C 177.10 -94.90 -118.18 -123.01 -113.47 . . 0 "[ . 1 . 2]"
28 . 1 40 SER C 1 41 ILE N 1 41 ILE CA 1 41 ILE C -79.85 -45.85 -63.57 -67.12 -67.70 . . 0 "[ . 1 . 2]"
29 . 1 41 ILE C 1 42 ASN N 1 42 ASN CA 1 42 ASN C -72.00 -52.00 -51.91 -51.93 -51.95 0.41 14 0 "[ . 1 . 2]"
30 . 1 42 ASN C 1 43 ASP N 1 43 ASP CA 1 43 ASP C -76.40 -48.40 -76.88 -77.06 -76.73 0.66 18 0 "[ . 1 . 2]"
31 . 1 43 ASP C 1 44 TYR N 1 44 TYR CA 1 44 TYR C -75.30 -55.30 -70.64 -69.13 -70.06 . . 0 "[ . 1 . 2]"
32 . 1 44 TYR C 1 45 ILE N 1 45 ILE CA 1 45 ILE C -72.90 -54.90 -58.37 -60.29 -56.28 . . 0 "[ . 1 . 2]"
33 . 1 45 ILE C 1 46 HIS N 1 46 HIS CA 1 46 HIS C -72.60 -51.60 -73.50 -73.72 -73.32 1.12 17 0 "[ . 1 . 2]"
34 . 1 50 GLY C 1 51 LYS N 1 51 LYS CA 1 51 LYS C 179.10 -68.90 -76.07 -68.59 -68.63 0.61 6 0 "[ . 1 . 2]"
35 . 1 51 LYS C 1 52 GLU N 1 52 GLU CA 1 52 GLU C -174.80 -107.80 -136.60 -128.29 -129.55 . . 0 "[ . 1 . 2]"
36 . 1 52 GLU C 1 53 MET N 1 53 MET CA 1 53 MET C -167.60 -107.60 -124.11 -119.04 -119.99 . . 0 "[ . 1 . 2]"
37 . 1 53 MET C 1 54 ASP N 1 54 ASP CA 1 54 ASP C -98.10 -52.10 -63.25 -57.00 -57.35 . . 0 "[ . 1 . 2]"
38 . 1 55 LEU C 1 56 LEU N 1 56 LEU CA 1 56 LEU C -83.00 -39.00 -83.21 -83.68 -82.95 0.68 12 0 "[ . 1 . 2]"
39 . 1 57 ARG C 1 58 THR N 1 58 THR CA 1 58 THR C -177.50 -75.50 -98.39 -104.15 -105.73 . . 0 "[ . 1 . 2]"
40 . 1 58 THR C 1 59 THR N 1 59 THR CA 1 59 THR C -163.40 -97.40 -130.89 -136.78 -123.02 . . 0 "[ . 1 . 2]"
41 . 1 59 THR C 1 60 VAL N 1 60 VAL CA 1 60 VAL C -146.40 -95.20 -127.46 -114.86 -119.74 . . 0 "[ . 1 . 2]"
42 . 1 60 VAL C 1 61 LYS N 1 61 LYS CA 1 61 LYS C -155.80 -90.40 -132.85 -112.40 -121.25 0.19 18 0 "[ . 1 . 2]"
43 . 1 61 LYS C 1 62 VAL N 1 62 VAL CA 1 62 VAL C -150.00 -66.00 -120.62 -147.56 -78.98 . . 0 "[ . 1 . 2]"
44 . 1 64 GLY C 1 65 LYS N 1 65 LYS CA 1 65 LYS C -137.50 -25.50 -81.36 -77.13 -119.25 0.05 6 0 "[ . 1 . 2]"
45 . 1 66 ARG C 1 67 PRO N 1 67 PRO CA 1 67 PRO C -76.40 -52.40 -56.50 -53.01 -53.73 0.35 9 0 "[ . 1 . 2]"
46 . 1 69 ARG C 1 70 ALA N 1 70 ALA CA 1 70 ALA C -90.67 -54.67 -70.71 -68.72 -70.11 . . 0 "[ . 1 . 2]"
47 . 1 72 SER C 1 73 ALA N 1 73 ALA CA 1 73 ALA C -92.52 -52.52 -92.72 -92.67 -92.67 0.39 9 0 "[ . 1 . 2]"
48 . 1 77 SER C 1 78 ALA N 1 78 ALA CA 1 78 ALA C -90.21 -50.21 -77.66 -90.24 -58.73 0.03 2 0 "[ . 1 . 2]"
49 . 1 86 GLU C 1 87 GLU N 1 87 GLU CA 1 87 GLU C -71.70 -55.70 -63.12 -60.85 -61.08 . . 0 "[ . 1 . 2]"
50 . 1 88 GLU C 1 89 ASN N 1 89 ASN CA 1 89 ASN C -163.66 -39.66 -93.43 -139.51 -59.68 . . 0 "[ . 1 . 2]"
51 . 1 89 ASN C 1 90 PHE N 1 90 PHE CA 1 90 PHE C -133.84 -85.84 -100.93 -128.57 -85.64 0.20 3 0 "[ . 1 . 2]"
52 . 1 90 PHE C 1 91 GLU N 1 91 GLU CA 1 91 GLU C -151.10 -89.10 -142.98 -144.91 -146.61 0.23 14 0 "[ . 1 . 2]"
53 . 1 91 GLU C 1 92 PHE N 1 92 PHE CA 1 92 PHE C 175.90 -112.10 -126.16 -133.38 -119.25 . . 0 "[ . 1 . 2]"
54 . 1 92 PHE C 1 93 LEU N 1 93 LEU CA 1 93 LEU C -168.50 -105.30 -113.20 -115.88 -116.56 0.20 6 0 "[ . 1 . 2]"
55 . 1 93 LEU C 1 94 ILE N 1 94 ILE CA 1 94 ILE C -144.60 -96.60 -117.64 -130.26 -110.31 . . 0 "[ . 1 . 2]"
56 . 1 94 ILE C 1 95 VAL N 1 95 VAL CA 1 95 VAL C -134.20 -94.20 -100.68 -103.95 -96.75 . . 0 "[ . 1 . 2]"
57 . 1 95 VAL C 1 96 SER N 1 96 SER CA 1 96 SER C -152.80 -72.80 -95.03 -102.38 -88.54 . . 0 "[ . 1 . 2]"
58 . 1 96 SER C 1 97 SER N 1 97 SER CA 1 97 SER C -103.36 -39.36 -83.41 -88.37 -68.85 . . 0 "[ . 1 . 2]"
59 . 1 97 SER C 1 98 THR N 1 98 THR CA 1 98 THR C -125.36 -65.36 -104.93 -114.81 -97.91 . . 0 "[ . 1 . 2]"
60 . 1 99 GLY C 1 100 GLN N 1 100 GLN CA 1 100 GLN C -105.60 -45.60 -54.28 -76.30 -48.05 . . 0 "[ . 1 . 2]"
61 . 1 101 THR C 1 102 TRP N 1 102 TRP CA 1 102 TRP C -139.60 -83.60 -96.17 -101.21 -90.04 . . 0 "[ . 1 . 2]"
62 . 1 102 TRP C 1 103 HIS N 1 103 HIS CA 1 103 HIS C -173.70 -69.70 -95.00 -95.03 -95.78 . . 0 "[ . 1 . 2]"
63 . 1 103 HIS C 1 104 PHE N 1 104 PHE CA 1 104 PHE C -160.10 -92.10 -123.14 -122.59 -122.98 . . 0 "[ . 1 . 2]"
64 . 1 108 SER C 1 109 PHE N 1 109 PHE CA 1 109 PHE C -66.00 -50.80 -61.62 -66.16 -50.27 0.53 4 0 "[ . 1 . 2]"
65 . 1 109 PHE C 1 110 GLU N 1 110 GLU CA 1 110 GLU C -73.57 -55.57 -70.34 -73.83 -73.92 0.80 11 0 "[ . 1 . 2]"
66 . 1 110 GLU C 1 111 GLU N 1 111 GLU CA 1 111 GLU C -74.60 -56.60 -64.94 -60.08 -61.05 0.09 8 0 "[ . 1 . 2]"
67 . 1 111 GLU C 1 112 ARG N 1 112 ARG CA 1 112 ARG C -71.10 -57.10 -56.63 -57.05 -55.97 1.13 16 0 "[ . 1 . 2]"
68 . 1 112 ARG C 1 113 ASP N 1 113 ASP CA 1 113 ASP C -74.20 -50.20 -70.44 -74.85 -62.26 0.65 6 0 "[ . 1 . 2]"
69 . 1 113 ASP C 1 114 ALA N 1 114 ALA CA 1 114 ALA C -78.70 -52.70 -57.37 -70.97 -52.56 0.14 18 0 "[ . 1 . 2]"
70 . 1 114 ALA C 1 115 TRP N 1 115 TRP CA 1 115 TRP C -72.70 -56.70 -58.37 -63.48 -56.49 0.21 16 0 "[ . 1 . 2]"
71 . 1 115 TRP C 1 116 VAL N 1 116 VAL CA 1 116 VAL C -74.60 -53.40 -55.32 -57.63 -53.20 0.20 12 0 "[ . 1 . 2]"
72 . 1 120 GLU C 1 121 SER N 1 121 SER CA 1 121 SER C -82.40 -50.40 -67.01 -65.52 -66.00 . . 0 "[ . 1 . 2]"
73 . 1 121 SER C 1 122 GLN N 1 122 GLN CA 1 122 GLN C -70.70 -55.90 -65.53 -69.77 -60.81 . . 0 "[ . 1 . 2]"
74 . 1 122 GLN C 1 123 ILE N 1 123 ILE CA 1 123 ILE C -74.10 -48.50 -72.28 -70.51 -72.24 0.16 7 0 "[ . 1 . 2]"
75 . 1 123 ILE C 1 124 LEU N 1 124 LEU CA 1 124 LEU C -68.60 -51.20 -67.85 -60.70 -64.72 0.19 17 0 "[ . 1 . 2]"
76 . 1 124 LEU C 1 125 ALA N 1 125 ALA CA 1 125 ALA C -76.30 -51.50 -76.12 -76.51 -74.23 0.21 5 0 "[ . 1 . 2]"
77 . 1 125 ALA C 1 126 SER N 1 126 SER CA 1 126 SER C -93.90 -45.90 -79.77 -86.31 -71.41 . . 0 "[ . 1 . 2]"
78 . 1 2 ALA N 1 2 ALA CA 1 2 ALA C 1 3 ILE N 93.10 177.10 164.47 136.73 177.16 0.06 16 0 "[ . 1 . 2]"
79 . 1 3 ILE N 1 3 ILE CA 1 3 ILE C 1 4 PRO N 93.30 -176.70 134.45 132.38 132.02 . . 0 "[ . 1 . 2]"
80 . 1 4 PRO N 1 4 PRO CA 1 4 PRO C 1 5 ILE N 124.50 148.50 127.59 124.26 133.75 0.24 8 0 "[ . 1 . 2]"
81 . 1 6 LYS N 1 6 LYS CA 1 6 LYS C 1 7 GLN N 112.10 174.10 110.61 110.96 110.76 2.00 11 0 "[ . 1 . 2]"
82 . 1 7 GLN N 1 7 GLN CA 1 7 GLN C 1 8 SER N 108.40 -177.60 111.79 112.70 112.16 0.31 8 0 "[ . 1 . 2]"
83 . 1 8 SER N 1 8 SER CA 1 8 SER C 1 9 PHE N 114.80 -175.20 -175.37 -177.15 -174.99 0.21 13 0 "[ . 1 . 2]"
84 . 1 9 PHE N 1 9 PHE CA 1 9 PHE C 1 10 LEU N 103.80 177.80 136.05 122.53 149.38 . . 0 "[ . 1 . 2]"
85 . 1 10 LEU N 1 10 LEU CA 1 10 LEU C 1 11 LEU N 133.30 173.30 154.65 153.53 151.88 . . 0 "[ . 1 . 2]"
86 . 1 11 LEU N 1 11 LEU CA 1 11 LEU C 1 12 LYS N 100.74 158.74 136.54 141.80 139.46 . . 0 "[ . 1 . 2]"
87 . 1 12 LYS N 1 12 LYS CA 1 12 LYS C 1 13 ARG N 106.20 146.20 114.79 107.53 126.53 . . 0 "[ . 1 . 2]"
88 . 1 13 ARG N 1 13 ARG CA 1 13 ARG C 1 14 SER N 124.00 148.00 147.44 136.13 148.22 0.22 13 0 "[ . 1 . 2]"
89 . 1 17 SER N 1 17 SER CA 1 17 SER C 1 18 LEU N -57.10 -17.10 -45.69 -57.25 -34.64 0.15 10 0 "[ . 1 . 2]"
90 . 1 18 LEU N 1 18 LEU CA 1 18 LEU C 1 19 ASN N -72.60 15.40 -37.70 -57.44 -32.26 . . 0 "[ . 1 . 2]"
91 . 1 22 TRP N 1 22 TRP CA 1 22 TRP C 1 23 LYS N 113.30 150.50 138.97 136.99 136.82 0.08 11 0 "[ . 1 . 2]"
92 . 1 23 LYS N 1 23 LYS CA 1 23 LYS C 1 24 LYS N 104.20 165.20 157.40 162.73 161.61 . . 0 "[ . 1 . 2]"
93 . 1 24 LYS N 1 24 LYS CA 1 24 LYS C 1 25 LYS N 100.60 154.60 120.32 122.59 121.30 . . 0 "[ . 1 . 2]"
94 . 1 25 LYS N 1 25 LYS CA 1 25 LYS C 1 26 TYR N 105.90 -174.10 -179.32 166.77 -174.04 0.06 13 0 "[ . 1 . 2]"
95 . 1 26 TYR N 1 26 TYR CA 1 26 TYR C 1 27 VAL N 115.30 141.30 117.27 114.91 114.78 0.67 17 0 "[ . 1 . 2]"
96 . 1 27 VAL N 1 27 VAL CA 1 27 VAL C 1 28 THR N 103.10 161.10 147.39 144.52 152.78 . . 0 "[ . 1 . 2]"
97 . 1 28 THR N 1 28 THR CA 1 28 THR C 1 29 LEU N 110.80 152.80 112.19 110.39 124.70 0.41 18 0 "[ . 1 . 2]"
98 . 1 29 LEU N 1 29 LEU CA 1 29 LEU C 1 30 SER N 109.70 142.70 115.55 115.57 115.27 . . 0 "[ . 1 . 2]"
99 . 1 30 SER N 1 30 SER CA 1 30 SER C 1 31 SER N 102.00 -158.00 161.01 154.83 165.02 . . 0 "[ . 1 . 2]"
100 . 1 32 ASN N 1 32 ASN CA 1 32 ASN C 1 33 GLY N -16.08 25.32 26.09 25.92 26.25 0.93 10 0 "[ . 1 . 2]"
101 . 1 34 PHE N 1 34 PHE CA 1 34 PHE C 1 35 LEU N 123.70 175.70 128.11 123.45 144.78 0.25 15 0 "[ . 1 . 2]"
102 . 1 35 LEU N 1 35 LEU CA 1 35 LEU C 1 36 LEU N 117.40 151.00 117.02 116.88 116.80 0.60 1 0 "[ . 1 . 2]"
103 . 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 TYR N 120.20 -179.80 146.53 136.69 152.49 . . 0 "[ . 1 . 2]"
104 . 1 37 TYR N 1 37 TYR CA 1 37 TYR C 1 38 HIS N 125.30 169.30 130.33 125.00 137.04 0.30 3 0 "[ . 1 . 2]"
105 . 1 38 HIS N 1 38 HIS CA 1 38 HIS C 1 39 PRO N 114.20 166.20 160.69 162.52 162.02 . . 0 "[ . 1 . 2]"
106 . 1 41 ILE N 1 41 ILE CA 1 41 ILE C 1 42 ASN N -58.50 -22.50 -44.17 -44.51 -44.55 . . 0 "[ . 1 . 2]"
107 . 1 42 ASN N 1 42 ASN CA 1 42 ASN C 1 43 ASP N -56.20 -21.60 -27.69 -26.38 -26.40 . . 0 "[ . 1 . 2]"
108 . 1 43 ASP N 1 43 ASP CA 1 43 ASP C 1 44 TYR N -60.90 -28.10 -39.90 -42.77 -37.24 . . 0 "[ . 1 . 2]"
109 . 1 44 TYR N 1 44 TYR CA 1 44 TYR C 1 45 ILE N -51.00 -32.60 -51.22 -51.38 -51.01 0.38 17 0 "[ . 1 . 2]"
110 . 1 45 ILE N 1 45 ILE CA 1 45 ILE C 1 46 HIS N -62.86 -30.86 -62.01 -62.76 -61.29 . . 0 "[ . 1 . 2]"
111 . 1 46 HIS N 1 46 HIS CA 1 46 HIS C 1 47 SER N -46.70 -24.90 -24.68 -24.31 -24.39 0.59 2 0 "[ . 1 . 2]"
112 . 1 51 LYS N 1 51 LYS CA 1 51 LYS C 1 52 GLU N 124.70 -174.50 140.83 129.37 159.06 . . 0 "[ . 1 . 2]"
113 . 1 52 GLU N 1 52 GLU CA 1 52 GLU C 1 53 MET N 133.30 171.30 138.85 133.05 162.27 0.25 8 0 "[ . 1 . 2]"
114 . 1 53 MET N 1 53 MET CA 1 53 MET C 1 54 ASP N 100.00 154.40 128.01 121.91 121.04 . . 0 "[ . 1 . 2]"
115 . 1 54 ASP N 1 54 ASP CA 1 54 ASP C 1 55 LEU N 115.28 150.28 128.72 120.65 133.76 . . 0 "[ . 1 . 2]"
116 . 1 56 LEU N 1 56 LEU CA 1 56 LEU C 1 57 ARG N -61.56 -23.56 -55.67 -61.73 -40.86 0.17 5 0 "[ . 1 . 2]"
117 . 1 58 THR N 1 58 THR CA 1 58 THR C 1 59 THR N 133.90 161.90 161.73 161.90 161.80 0.31 17 0 "[ . 1 . 2]"
118 . 1 59 THR N 1 59 THR CA 1 59 THR C 1 60 VAL N 116.95 176.95 163.07 156.72 153.11 . . 0 "[ . 1 . 2]"
119 . 1 60 VAL N 1 60 VAL CA 1 60 VAL C 1 61 LYS N 110.40 150.40 124.72 114.35 132.82 . . 0 "[ . 1 . 2]"
120 . 1 61 LYS N 1 61 LYS CA 1 61 LYS C 1 62 VAL N 116.35 164.35 158.49 160.66 159.40 0.40 8 0 "[ . 1 . 2]"
121 . 1 62 VAL N 1 62 VAL CA 1 62 VAL C 1 63 PRO N 90.75 170.75 136.81 102.51 157.22 . . 0 "[ . 1 . 2]"
122 . 1 65 LYS N 1 65 LYS CA 1 65 LYS C 1 66 ARG N 101.20 173.20 157.00 166.62 155.90 0.18 3 0 "[ . 1 . 2]"
123 . 1 67 PRO N 1 67 PRO CA 1 67 PRO C 1 68 PRO N 118.80 168.80 125.44 118.35 148.72 0.45 2 0 "[ . 1 . 2]"
124 . 1 70 ALA N 1 70 ALA CA 1 70 ALA C 1 71 ILE N -56.20 -12.20 -42.98 -33.62 -38.23 0.15 5 0 "[ . 1 . 2]"
125 . 1 73 ALA N 1 73 ALA CA 1 73 ALA C 1 74 PHE N -75.46 16.54 17.58 17.58 17.57 1.16 9 0 "[ . 1 . 2]"
126 . 1 78 ALA N 1 78 ALA CA 1 78 ALA C 1 79 SER N -63.20 -5.20 -34.65 -63.42 -21.75 0.22 10 0 "[ . 1 . 2]"
127 . 1 87 GLU N 1 87 GLU CA 1 87 GLU C 1 88 GLU N -56.30 -24.30 -36.53 -30.93 -37.64 0.34 20 0 "[ . 1 . 2]"
128 . 1 89 ASN N 1 89 ASN CA 1 89 ASN C 1 90 PHE N 103.98 -170.02 105.25 106.24 104.70 0.61 18 0 "[ . 1 . 2]"
129 . 1 90 PHE N 1 90 PHE CA 1 90 PHE C 1 91 GLU N 104.20 150.20 113.46 104.03 104.03 0.51 14 0 "[ . 1 . 2]"
130 . 1 91 GLU N 1 91 GLU CA 1 91 GLU C 1 92 PHE N 129.96 175.96 132.05 130.10 129.99 0.19 3 0 "[ . 1 . 2]"
131 . 1 92 PHE N 1 92 PHE CA 1 92 PHE C 1 93 LEU N 123.50 -176.50 150.54 153.18 152.97 . . 0 "[ . 1 . 2]"
132 . 1 93 LEU N 1 93 LEU CA 1 93 LEU C 1 94 ILE N 107.40 175.40 145.79 159.56 150.83 . . 0 "[ . 1 . 2]"
133 . 1 94 ILE N 1 94 ILE CA 1 94 ILE C 1 95 VAL N 109.00 147.00 109.06 108.57 108.49 0.68 4 0 "[ . 1 . 2]"
134 . 1 95 VAL N 1 95 VAL CA 1 95 VAL C 1 96 SER N 106.40 148.40 130.70 131.63 130.51 . . 0 "[ . 1 . 2]"
135 . 1 96 SER N 1 96 SER CA 1 96 SER C 1 97 SER N 89.80 -174.20 -175.29 171.61 -173.91 0.29 1 0 "[ . 1 . 2]"
136 . 1 97 SER N 1 97 SER CA 1 97 SER C 1 98 THR N -42.00 0.00 -12.12 -6.45 -11.04 0.01 17 0 "[ . 1 . 2]"
137 . 1 98 THR N 1 98 THR CA 1 98 THR C 1 99 GLY N -27.80 38.20 23.30 21.07 24.57 . . 0 "[ . 1 . 2]"
138 . 1 100 GLN N 1 100 GLN CA 1 100 GLN C 1 101 THR N 115.50 151.50 126.00 123.39 120.30 0.03 14 0 "[ . 1 . 2]"
139 . 1 101 THR N 1 101 THR CA 1 101 THR C 1 102 TRP N 115.00 141.00 114.78 114.68 114.64 0.45 13 0 "[ . 1 . 2]"
140 . 1 102 TRP N 1 102 TRP CA 1 102 TRP C 1 103 HIS N 105.67 155.67 105.94 105.39 109.08 0.28 20 0 "[ . 1 . 2]"
141 . 1 103 HIS N 1 103 HIS CA 1 103 HIS C 1 104 PHE N 116.80 168.80 116.27 115.92 116.55 0.88 5 0 "[ . 1 . 2]"
142 . 1 104 PHE N 1 104 PHE CA 1 104 PHE C 1 105 GLU N 113.10 177.10 161.68 162.71 161.56 . . 0 "[ . 1 . 2]"
143 . 1 105 GLU N 1 105 GLU CA 1 105 GLU C 1 106 ALA N 92.20 156.20 104.53 103.18 102.49 . . 0 "[ . 1 . 2]"
144 . 1 109 PHE N 1 109 PHE CA 1 109 PHE C 1 110 GLU N -57.10 -27.10 -40.70 -55.66 -29.37 . . 0 "[ . 1 . 2]"
145 . 1 110 GLU N 1 110 GLU CA 1 110 GLU C 1 111 GLU N -48.80 -32.80 -35.45 -33.45 -35.23 0.26 8 0 "[ . 1 . 2]"
146 . 1 111 GLU N 1 111 GLU CA 1 111 GLU C 1 112 ARG N -52.15 -32.15 -36.56 -40.53 -41.06 0.61 16 0 "[ . 1 . 2]"
147 . 1 112 ARG N 1 112 ARG CA 1 112 ARG C 1 113 ASP N -49.40 -31.00 -44.39 -34.13 -35.21 0.33 8 0 "[ . 1 . 2]"
148 . 1 113 ASP N 1 113 ASP CA 1 113 ASP C 1 114 ALA N -58.30 -17.70 -42.89 -43.84 -45.60 . . 0 "[ . 1 . 2]"
149 . 1 114 ALA N 1 114 ALA CA 1 114 ALA C 1 115 TRP N -53.20 -29.20 -50.55 -46.53 -46.55 0.20 8 0 "[ . 1 . 2]"
150 . 1 116 VAL N 1 116 VAL CA 1 116 VAL C 1 117 GLN N -59.40 -31.40 -35.27 -32.44 -33.54 . . 0 "[ . 1 . 2]"
151 . 1 117 GLN N 1 117 GLN CA 1 117 GLN C 1 118 ALA N -56.80 -20.80 -29.85 -33.89 -27.03 . . 0 "[ . 1 . 2]"
152 . 1 118 ALA N 1 118 ALA CA 1 118 ALA C 1 119 ILE N -51.80 -30.80 -44.87 -51.77 -35.24 . . 0 "[ . 1 . 2]"
153 . 1 119 ILE N 1 119 ILE CA 1 119 ILE C 1 120 GLU N -52.00 -37.60 -49.35 -52.35 -46.12 0.35 12 0 "[ . 1 . 2]"
154 . 1 120 GLU N 1 120 GLU CA 1 120 GLU C 1 121 SER N -50.90 -32.90 -32.75 -32.72 -32.76 0.36 13 0 "[ . 1 . 2]"
155 . 1 121 SER N 1 121 SER CA 1 121 SER C 1 122 GLN N -49.50 -29.50 -43.56 -49.50 -38.60 . . 0 "[ . 1 . 2]"
156 . 1 122 GLN N 1 122 GLN CA 1 122 GLN C 1 123 ILE N -50.70 -30.70 -33.72 -39.67 -31.07 . . 0 "[ . 1 . 2]"
157 . 1 123 ILE N 1 123 ILE CA 1 123 ILE C 1 124 LEU N -57.20 -33.20 -37.27 -44.42 -33.15 0.05 11 0 "[ . 1 . 2]"
158 . 1 124 LEU N 1 124 LEU CA 1 124 LEU C 1 125 ALA N -50.90 -34.30 -36.47 -41.36 -34.31 . . 0 "[ . 1 . 2]"
159 . 1 125 ALA N 1 125 ALA CA 1 125 ALA C 1 126 SER N -62.26 -10.26 -31.16 -33.60 -35.14 . . 0 "[ . 1 . 2]"
160 . 1 126 SER N 1 126 SER CA 1 126 SER C 1 127 LEU N -52.00 -10.00 -31.29 -35.04 -28.81 . . 0 "[ . 1 . 2]"
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