NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
589568 |
2mui   |
6644 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mui
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 154
_TA_constraint_stats_list.Viol_count 648
_TA_constraint_stats_list.Viol_total 10268.72
_TA_constraint_stats_list.Viol_max 2.93
_TA_constraint_stats_list.Viol_rms 0.44
_TA_constraint_stats_list.Viol_average_all_restraints 0.17
_TA_constraint_stats_list.Viol_average_violations_only 0.79
_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 46 ASN C 1 47 ARG N 1 47 ARG CA 1 47 ARG C -128.00 -88.00 -129.90 -129.68 -129.70 2.39 6 0 "[ . 1 . 2]"
2 . 1 47 ARG C 1 48 PRO N 1 48 PRO CA 1 48 PRO C -79.00 -39.00 -59.32 -61.09 -57.82 . . 0 "[ . 1 . 2]"
3 . 1 50 GLY C 1 51 LEU N 1 51 LEU CA 1 51 LEU C -133.00 -73.00 -122.43 -134.97 -81.43 1.97 12 0 "[ . 1 . 2]"
4 . 1 51 LEU C 1 52 ASN N 1 52 ASN CA 1 52 ASN C -112.00 -72.00 -109.24 -105.79 -112.07 0.79 11 0 "[ . 1 . 2]"
5 . 1 72 HIS C 1 73 ILE N 1 73 ILE CA 1 73 ILE C -122.00 -62.00 -118.99 -122.28 -108.64 0.28 2 0 "[ . 1 . 2]"
6 . 1 73 ILE C 1 74 ASP N 1 74 ASP CA 1 74 ASP C -141.00 -81.00 -106.58 -109.56 -103.49 . . 0 "[ . 1 . 2]"
7 . 1 74 ASP C 1 75 ILE N 1 75 ILE CA 1 75 ILE C -117.00 -77.00 -105.34 -108.23 -111.81 . . 0 "[ . 1 . 2]"
8 . 1 76 TYR C 1 77 ASN N 1 77 ASN CA 1 77 ASN C -108.00 -68.00 -85.91 -83.72 -84.21 . . 0 "[ . 1 . 2]"
9 . 1 77 ASN C 1 78 GLY N 1 78 GLY CA 1 78 GLY C -104.00 -64.00 -102.66 -104.14 -99.53 0.14 14 0 "[ . 1 . 2]"
10 . 1 79 GLY C 1 80 PRO N 1 80 PRO CA 1 80 PRO C -88.00 -48.00 -88.46 -88.49 -88.55 0.75 11 0 "[ . 1 . 2]"
11 . 1 80 PRO C 1 81 VAL N 1 81 VAL CA 1 81 VAL C -116.00 -76.00 -85.34 -89.29 -82.11 . . 0 "[ . 1 . 2]"
12 . 1 82 GLN C 1 83 THR N 1 83 THR CA 1 83 THR C -88.00 -48.00 -84.19 -88.09 -79.37 0.09 15 0 "[ . 1 . 2]"
13 . 1 83 THR C 1 84 ASP N 1 84 ASP CA 1 84 ASP C -117.00 -77.00 -88.09 -88.68 -88.87 0.09 14 0 "[ . 1 . 2]"
14 . 1 84 ASP C 1 85 ARG N 1 85 ARG CA 1 85 ARG C -132.00 -92.00 -132.99 -133.43 -132.58 1.43 9 0 "[ . 1 . 2]"
15 . 1 85 ARG C 1 86 GLY N 1 86 GLY CA 1 86 GLY C -151.00 -111.00 -109.95 -108.51 -108.58 2.72 9 0 "[ . 1 . 2]"
16 . 1 86 GLY C 1 87 PHE N 1 87 PHE CA 1 87 PHE C -127.00 -87.00 -86.67 -85.91 -86.16 1.46 15 0 "[ . 1 . 2]"
17 . 1 87 PHE C 1 88 VAL N 1 88 VAL CA 1 88 VAL C -134.00 -94.00 -125.10 -128.37 -116.31 . . 0 "[ . 1 . 2]"
18 . 1 88 VAL C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -138.00 -98.00 -105.87 -114.23 -98.28 . . 0 "[ . 1 . 2]"
19 . 1 124 GLU C 1 125 LYS N 1 125 LYS CA 1 125 LYS C -171.00 -111.00 -139.99 -140.19 -140.72 . . 0 "[ . 1 . 2]"
20 . 1 125 LYS C 1 126 SER N 1 126 SER CA 1 126 SER C -150.00 -90.00 -143.20 -152.52 -137.02 2.52 13 0 "[ . 1 . 2]"
21 . 1 126 SER C 1 127 LEU N 1 127 LEU CA 1 127 LEU C -146.00 -106.00 -127.29 -130.31 -125.38 . . 0 "[ . 1 . 2]"
22 . 1 127 LEU C 1 128 ILE N 1 128 ILE CA 1 128 ILE C -133.00 -93.00 -97.97 -98.18 -98.26 0.18 13 0 "[ . 1 . 2]"
23 . 1 128 ILE C 1 129 SER N 1 129 SER CA 1 129 SER C -130.00 -90.00 -121.36 -120.26 -121.02 . . 0 "[ . 1 . 2]"
24 . 1 129 SER C 1 130 LEU N 1 130 LEU CA 1 130 LEU C -108.00 -68.00 -67.13 -67.21 -67.32 1.42 6 0 "[ . 1 . 2]"
25 . 1 131 GLY C 1 132 TYR N 1 132 TYR CA 1 132 TYR C -169.00 -129.00 -128.47 -128.68 -127.82 1.18 6 0 "[ . 1 . 2]"
26 . 1 132 TYR C 1 133 ALA N 1 133 ALA CA 1 133 ALA C -161.00 -101.00 -116.02 -119.39 -108.86 . . 0 "[ . 1 . 2]"
27 . 1 133 ALA C 1 134 GLY N 1 134 GLY CA 1 134 GLY C -139.00 -99.00 -129.13 -130.58 -128.23 . . 0 "[ . 1 . 2]"
28 . 1 134 GLY C 1 135 TRP N 1 135 TRP CA 1 135 TRP C -137.00 -97.00 -125.38 -134.17 -113.88 . . 0 "[ . 1 . 2]"
29 . 1 135 TRP C 1 136 GLU N 1 136 GLU CA 1 136 GLU C -118.00 -78.00 -79.93 -80.62 -81.05 . . 0 "[ . 1 . 2]"
30 . 1 48 PRO N 1 48 PRO CA 1 48 PRO C 1 49 SER N 128.00 168.00 143.27 139.38 147.29 . . 0 "[ . 1 . 2]"
31 . 1 51 LEU N 1 51 LEU CA 1 51 LEU C 1 52 ASN N 133.00 173.00 157.60 150.95 170.27 . . 0 "[ . 1 . 2]"
32 . 1 52 ASN N 1 52 ASN CA 1 52 ASN C 1 53 LEU N 148.00 -172.00 159.38 161.09 161.08 . . 0 "[ . 1 . 2]"
33 . 1 73 ILE N 1 73 ILE CA 1 73 ILE C 1 74 ASP N 106.00 166.00 138.82 138.97 138.63 . . 0 "[ . 1 . 2]"
34 . 1 74 ASP N 1 74 ASP CA 1 74 ASP C 1 75 ILE N 144.00 -176.00 156.88 151.46 164.17 . . 0 "[ . 1 . 2]"
35 . 1 75 ILE N 1 75 ILE CA 1 75 ILE C 1 76 TYR N 97.00 157.00 152.76 153.41 153.12 . . 0 "[ . 1 . 2]"
36 . 1 76 TYR N 1 76 TYR CA 1 76 TYR C 1 77 ASN N 124.00 164.00 155.18 152.48 157.08 . . 0 "[ . 1 . 2]"
37 . 1 77 ASN N 1 77 ASN CA 1 77 ASN C 1 78 GLY N 107.00 147.00 120.38 119.20 118.94 . . 0 "[ . 1 . 2]"
38 . 1 78 GLY N 1 78 GLY CA 1 78 GLY C 1 79 GLY N -21.00 19.00 -23.63 -23.76 -23.93 2.93 1 0 "[ . 1 . 2]"
39 . 1 79 GLY N 1 79 GLY CA 1 79 GLY C 1 80 PRO N 152.00 -168.00 -167.90 -168.48 -167.31 0.69 10 0 "[ . 1 . 2]"
40 . 1 81 VAL N 1 81 VAL CA 1 81 VAL C 1 82 GLN N 113.00 153.00 128.52 124.07 131.85 . . 0 "[ . 1 . 2]"
41 . 1 83 THR N 1 83 THR CA 1 83 THR C 1 84 ASP N -39.00 1.00 -5.96 -2.45 -4.41 0.96 20 0 "[ . 1 . 2]"
42 . 1 84 ASP N 1 84 ASP CA 1 84 ASP C 1 85 ARG N -18.00 22.00 -8.05 -18.40 3.95 0.40 18 0 "[ . 1 . 2]"
43 . 1 85 ARG N 1 85 ARG CA 1 85 ARG C 1 86 GLY N 139.00 179.00 151.43 152.85 152.13 . . 0 "[ . 1 . 2]"
44 . 1 86 GLY N 1 86 GLY CA 1 86 GLY C 1 87 PHE N 125.00 165.00 139.33 126.00 159.75 . . 0 "[ . 1 . 2]"
45 . 1 87 PHE N 1 87 PHE CA 1 87 PHE C 1 88 VAL N 114.00 154.00 147.42 149.37 146.16 . . 0 "[ . 1 . 2]"
46 . 1 88 VAL N 1 88 VAL CA 1 88 VAL C 1 89 LEU N 104.00 144.00 105.69 105.69 104.81 1.09 16 0 "[ . 1 . 2]"
47 . 1 89 LEU N 1 89 LEU CA 1 89 LEU C 1 90 HIS N 128.00 168.00 128.02 126.72 129.53 1.28 3 0 "[ . 1 . 2]"
48 . 1 125 LYS N 1 125 LYS CA 1 125 LYS C 1 126 SER N 140.00 -160.00 146.51 139.69 168.41 0.31 6 0 "[ . 1 . 2]"
49 . 1 126 SER N 1 126 SER CA 1 126 SER C 1 127 LEU N 134.00 174.00 165.73 167.82 166.83 . . 0 "[ . 1 . 2]"
50 . 1 127 LEU N 1 127 LEU CA 1 127 LEU C 1 128 ILE N 106.00 146.00 116.35 117.02 116.46 . . 0 "[ . 1 . 2]"
51 . 1 128 ILE N 1 128 ILE CA 1 128 ILE C 1 129 SER N 103.00 143.00 103.11 102.00 107.86 1.00 12 0 "[ . 1 . 2]"
52 . 1 129 SER N 1 129 SER CA 1 129 SER C 1 130 LEU N 118.00 158.00 122.45 119.13 130.65 . . 0 "[ . 1 . 2]"
53 . 1 130 LEU N 1 130 LEU CA 1 130 LEU C 1 131 GLY N 113.00 153.00 115.01 112.73 118.22 0.27 20 0 "[ . 1 . 2]"
54 . 1 131 GLY N 1 131 GLY CA 1 131 GLY C 1 132 TYR N 144.00 -156.00 173.15 174.61 174.15 . . 0 "[ . 1 . 2]"
55 . 1 132 TYR N 1 132 TYR CA 1 132 TYR C 1 133 ALA N 145.00 -175.00 178.16 171.97 -176.00 . . 0 "[ . 1 . 2]"
56 . 1 133 ALA N 1 133 ALA CA 1 133 ALA C 1 134 GLY N 122.00 162.00 130.35 128.77 127.90 . . 0 "[ . 1 . 2]"
57 . 1 134 GLY N 1 134 GLY CA 1 134 GLY C 1 135 TRP N 114.00 154.00 147.62 145.90 144.34 . . 0 "[ . 1 . 2]"
58 . 1 135 TRP N 1 135 TRP CA 1 135 TRP C 1 136 GLU N 122.00 162.00 136.19 131.68 139.02 . . 0 "[ . 1 . 2]"
59 . 1 136 GLU N 1 136 GLU CA 1 136 GLU C 1 137 ALA N 118.00 158.00 158.26 158.27 158.17 1.19 14 0 "[ . 1 . 2]"
60 . 1 22 ASP C 1 23 PRO N 1 23 PRO CA 1 23 PRO C -75.00 -35.00 -75.30 -75.38 -75.41 0.55 4 0 "[ . 1 . 2]"
61 . 1 23 PRO C 1 24 ASN N 1 24 ASN CA 1 24 ASN C -84.00 -44.00 -84.86 -85.20 -85.53 1.53 1 0 "[ . 1 . 2]"
62 . 1 24 ASN C 1 25 PHE N 1 25 PHE CA 1 25 PHE C -128.00 -88.00 -91.85 -98.26 -90.29 . . 0 "[ . 1 . 2]"
63 . 1 25 PHE C 1 26 ALA N 1 26 ALA CA 1 26 ALA C -83.00 -43.00 -64.36 -66.78 -66.97 . . 0 "[ . 1 . 2]"
64 . 1 52 ASN C 1 53 LEU N 1 53 LEU CA 1 53 LEU C -77.00 -37.00 -58.27 -58.19 -58.36 . . 0 "[ . 1 . 2]"
65 . 1 53 LEU C 1 54 ALA N 1 54 ALA CA 1 54 ALA C -77.00 -37.00 -59.48 -55.53 -58.83 . . 0 "[ . 1 . 2]"
66 . 1 54 ALA C 1 55 GLU N 1 55 GLU CA 1 55 GLU C -77.00 -37.00 -64.04 -64.10 -64.37 . . 0 "[ . 1 . 2]"
67 . 1 55 GLU C 1 56 VAL N 1 56 VAL CA 1 56 VAL C -77.00 -37.00 -62.17 -63.24 -61.42 . . 0 "[ . 1 . 2]"
68 . 1 56 VAL C 1 57 LEU N 1 57 LEU CA 1 57 LEU C -77.00 -37.00 -55.08 -52.89 -53.50 . . 0 "[ . 1 . 2]"
69 . 1 57 LEU C 1 58 GLU N 1 58 GLU CA 1 58 GLU C -77.00 -37.00 -78.05 -78.34 -77.76 1.34 20 0 "[ . 1 . 2]"
70 . 1 58 GLU C 1 59 GLN N 1 59 GLN CA 1 59 GLN C -77.00 -37.00 -78.08 -78.72 -77.67 1.72 19 0 "[ . 1 . 2]"
71 . 1 59 GLN C 1 60 LEU N 1 60 LEU CA 1 60 LEU C -77.00 -37.00 -77.79 -77.89 -77.93 0.94 1 0 "[ . 1 . 2]"
72 . 1 67 PRO C 1 68 ALA N 1 68 ALA CA 1 68 ALA C -77.00 -37.00 -68.15 -66.75 -68.43 0.09 1 0 "[ . 1 . 2]"
73 . 1 68 ALA C 1 69 ARG N 1 69 ARG CA 1 69 ARG C -77.00 -37.00 -67.14 -67.39 -67.86 . . 0 "[ . 1 . 2]"
74 . 1 69 ARG C 1 70 CYS N 1 70 CYS CA 1 70 CYS C -77.00 -37.00 -72.30 -75.49 -65.59 . . 0 "[ . 1 . 2]"
75 . 1 70 CYS C 1 71 GLN N 1 71 GLN CA 1 71 GLN C -77.00 -37.00 -68.92 -72.83 -65.75 . . 0 "[ . 1 . 2]"
76 . 1 110 SER C 1 111 GLN N 1 111 GLN CA 1 111 GLN C -77.00 -37.00 -60.96 -62.70 -57.95 . . 0 "[ . 1 . 2]"
77 . 1 111 GLN C 1 112 ASP N 1 112 ASP CA 1 112 ASP C -77.00 -37.00 -64.43 -66.11 -62.29 . . 0 "[ . 1 . 2]"
78 . 1 112 ASP C 1 113 VAL N 1 113 VAL CA 1 113 VAL C -77.00 -37.00 -67.86 -67.38 -67.75 . . 0 "[ . 1 . 2]"
79 . 1 113 VAL C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -77.00 -37.00 -57.46 -59.36 -54.57 . . 0 "[ . 1 . 2]"
80 . 1 114 LEU C 1 115 PHE N 1 115 PHE CA 1 115 PHE C -77.00 -37.00 -67.95 -69.98 -64.86 . . 0 "[ . 1 . 2]"
81 . 1 115 PHE C 1 116 ALA N 1 116 ALA CA 1 116 ALA C -77.00 -37.00 -60.89 -62.25 -58.08 . . 0 "[ . 1 . 2]"
82 . 1 116 ALA C 1 117 ILE N 1 117 ILE CA 1 117 ILE C -77.00 -37.00 -64.74 -64.75 -64.81 . . 0 "[ . 1 . 2]"
83 . 1 117 ILE C 1 118 ALA N 1 118 ALA CA 1 118 ALA C -77.00 -37.00 -57.08 -57.92 -56.33 . . 0 "[ . 1 . 2]"
84 . 1 138 GLY C 1 139 GLN N 1 139 GLN CA 1 139 GLN C -77.00 -37.00 -57.31 -57.88 -57.95 . . 0 "[ . 1 . 2]"
85 . 1 139 GLN C 1 140 LEU N 1 140 LEU CA 1 140 LEU C -77.00 -37.00 -67.74 -68.98 -66.23 . . 0 "[ . 1 . 2]"
86 . 1 140 LEU C 1 141 GLU N 1 141 GLU CA 1 141 GLU C -77.00 -37.00 -58.68 -60.62 -56.69 . . 0 "[ . 1 . 2]"
87 . 1 141 GLU C 1 142 ALA N 1 142 ALA CA 1 142 ALA C -77.00 -37.00 -70.24 -70.14 -70.14 . . 0 "[ . 1 . 2]"
88 . 1 142 ALA C 1 143 GLU N 1 143 GLU CA 1 143 GLU C -77.00 -37.00 -71.12 -72.69 -69.47 . . 0 "[ . 1 . 2]"
89 . 1 143 GLU C 1 144 LEU N 1 144 LEU CA 1 144 LEU C -77.00 -37.00 -75.30 -76.05 -74.18 . . 0 "[ . 1 . 2]"
90 . 1 144 LEU C 1 145 SER N 1 145 SER CA 1 145 SER C -77.00 -37.00 -77.96 -78.23 -77.75 1.23 10 0 "[ . 1 . 2]"
91 . 1 155 ASP C 1 156 PRO N 1 156 PRO CA 1 156 PRO C -77.00 -37.00 -73.61 -76.11 -72.46 . . 0 "[ . 1 . 2]"
92 . 1 156 PRO C 1 157 ALA N 1 157 ALA CA 1 157 ALA C -77.00 -37.00 -51.89 -52.71 -52.77 . . 0 "[ . 1 . 2]"
93 . 1 157 ALA C 1 158 ILE N 1 158 ILE CA 1 158 ILE C -77.00 -37.00 -70.79 -71.25 -71.36 . . 0 "[ . 1 . 2]"
94 . 1 158 ILE C 1 159 LEU N 1 159 LEU CA 1 159 LEU C -77.00 -37.00 -74.26 -76.66 -69.44 . . 0 "[ . 1 . 2]"
95 . 1 166 GLU C 1 167 ARG N 1 167 ARG CA 1 167 ARG C -77.00 -37.00 -76.86 -76.96 -77.01 0.19 3 0 "[ . 1 . 2]"
96 . 1 167 ARG C 1 168 LEU N 1 168 LEU CA 1 168 LEU C -77.00 -37.00 -70.58 -70.65 -70.85 . . 0 "[ . 1 . 2]"
97 . 1 168 LEU C 1 169 SER N 1 169 SER CA 1 169 SER C -77.00 -37.00 -58.24 -58.39 -58.41 . . 0 "[ . 1 . 2]"
98 . 1 169 SER C 1 170 ALA N 1 170 ALA CA 1 170 ALA C -77.00 -37.00 -64.30 -64.39 -64.70 . . 0 "[ . 1 . 2]"
99 . 1 170 ALA C 1 171 ALA N 1 171 ALA CA 1 171 ALA C -77.00 -37.00 -56.36 -58.09 -55.76 . . 0 "[ . 1 . 2]"
100 . 1 171 ALA C 1 172 ALA N 1 172 ALA CA 1 172 ALA C -77.00 -37.00 -64.28 -66.38 -63.02 . . 0 "[ . 1 . 2]"
101 . 1 172 ALA C 1 173 ALA N 1 173 ALA CA 1 173 ALA C -77.00 -37.00 -64.79 -64.58 -64.96 . . 0 "[ . 1 . 2]"
102 . 1 173 ALA C 1 174 ARG N 1 174 ARG CA 1 174 ARG C -77.00 -37.00 -77.70 -78.05 -77.16 1.05 7 0 "[ . 1 . 2]"
103 . 1 174 ARG C 1 175 LEU N 1 175 LEU CA 1 175 LEU C -77.00 -37.00 -69.42 -68.58 -69.61 . . 0 "[ . 1 . 2]"
104 . 1 178 ASN C 1 179 LEU N 1 179 LEU CA 1 179 LEU C -77.00 -37.00 -77.80 -77.99 -77.65 0.99 15 0 "[ . 1 . 2]"
105 . 1 179 LEU C 1 180 SER N 1 180 SER CA 1 180 SER C -77.00 -37.00 -58.43 -58.39 -58.50 . . 0 "[ . 1 . 2]"
106 . 1 180 SER C 1 181 LEU N 1 181 LEU CA 1 181 LEU C -77.00 -37.00 -77.44 -77.47 -77.51 0.64 20 0 "[ . 1 . 2]"
107 . 1 181 LEU C 1 182 LEU N 1 182 LEU CA 1 182 LEU C -77.00 -37.00 -76.98 -77.28 -76.09 0.28 15 0 "[ . 1 . 2]"
108 . 1 23 PRO N 1 23 PRO CA 1 23 PRO C 1 24 ASN N -54.00 -14.00 -21.71 -24.87 -13.92 0.08 11 0 "[ . 1 . 2]"
109 . 1 24 ASN N 1 24 ASN CA 1 24 ASN C 1 25 PHE N -49.00 -9.00 -37.02 -37.38 -37.78 . . 0 "[ . 1 . 2]"
110 . 1 25 PHE N 1 25 PHE CA 1 25 PHE C 1 26 ALA N -37.00 3.00 0.64 3.06 2.67 1.01 6 0 "[ . 1 . 2]"
111 . 1 53 LEU N 1 53 LEU CA 1 53 LEU C 1 54 ALA N -67.00 -27.00 -31.38 -37.85 -26.51 0.49 16 0 "[ . 1 . 2]"
112 . 1 54 ALA N 1 54 ALA CA 1 54 ALA C 1 55 GLU N -67.00 -27.00 -39.48 -41.68 -42.50 . . 0 "[ . 1 . 2]"
113 . 1 55 GLU N 1 55 GLU CA 1 55 GLU C 1 56 VAL N -67.00 -27.00 -44.78 -45.78 -46.52 . . 0 "[ . 1 . 2]"
114 . 1 56 VAL N 1 56 VAL CA 1 56 VAL C 1 57 LEU N -67.00 -27.00 -45.87 -50.82 -43.45 . . 0 "[ . 1 . 2]"
115 . 1 57 LEU N 1 57 LEU CA 1 57 LEU C 1 58 GLU N -67.00 -27.00 -35.68 -36.80 -33.85 . . 0 "[ . 1 . 2]"
116 . 1 58 GLU N 1 58 GLU CA 1 58 GLU C 1 59 GLN N -67.00 -27.00 -27.99 -29.46 -27.25 . . 0 "[ . 1 . 2]"
117 . 1 59 GLN N 1 59 GLN CA 1 59 GLN C 1 60 LEU N -67.00 -27.00 -30.63 -31.80 -29.97 . . 0 "[ . 1 . 2]"
118 . 1 60 LEU N 1 60 LEU CA 1 60 LEU C 1 61 LYS N -67.00 -27.00 -45.46 -45.62 -45.76 . . 0 "[ . 1 . 2]"
119 . 1 68 ALA N 1 68 ALA CA 1 68 ALA C 1 69 ARG N -67.00 -27.00 -24.78 -24.64 -24.74 2.50 17 0 "[ . 1 . 2]"
120 . 1 69 ARG N 1 69 ARG CA 1 69 ARG C 1 70 CYS N -67.00 -27.00 -49.47 -55.58 -45.42 . . 0 "[ . 1 . 2]"
121 . 1 70 CYS N 1 70 CYS CA 1 70 CYS C 1 71 GLN N -67.00 -27.00 -26.04 -26.19 -29.57 2.03 3 0 "[ . 1 . 2]"
122 . 1 71 GLN N 1 71 GLN CA 1 71 GLN C 1 72 HIS N -67.00 -27.00 -30.87 -36.02 -26.84 0.16 1 0 "[ . 1 . 2]"
123 . 1 111 GLN N 1 111 GLN CA 1 111 GLN C 1 112 ASP N -67.00 -27.00 -27.94 -28.81 -29.11 1.04 10 0 "[ . 1 . 2]"
124 . 1 112 ASP N 1 112 ASP CA 1 112 ASP C 1 113 VAL N -67.00 -27.00 -42.80 -42.41 -42.86 . . 0 "[ . 1 . 2]"
125 . 1 113 VAL N 1 113 VAL CA 1 113 VAL C 1 114 LEU N -67.00 -27.00 -39.06 -43.46 -34.83 . . 0 "[ . 1 . 2]"
126 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C 1 115 PHE N -67.00 -27.00 -49.14 -47.36 -47.64 . . 0 "[ . 1 . 2]"
127 . 1 115 PHE N 1 115 PHE CA 1 115 PHE C 1 116 ALA N -67.00 -27.00 -40.66 -38.74 -39.17 . . 0 "[ . 1 . 2]"
128 . 1 116 ALA N 1 116 ALA CA 1 116 ALA C 1 117 ILE N -67.00 -27.00 -52.63 -52.10 -52.45 . . 0 "[ . 1 . 2]"
129 . 1 117 ILE N 1 117 ILE CA 1 117 ILE C 1 118 ALA N -67.00 -27.00 -43.59 -43.47 -43.57 . . 0 "[ . 1 . 2]"
130 . 1 118 ALA N 1 118 ALA CA 1 118 ALA C 1 119 ALA N -67.00 -27.00 -31.63 -31.73 -32.03 . . 0 "[ . 1 . 2]"
131 . 1 139 GLN N 1 139 GLN CA 1 139 GLN C 1 140 LEU N -67.00 -27.00 -45.91 -44.38 -44.55 . . 0 "[ . 1 . 2]"
132 . 1 140 LEU N 1 140 LEU CA 1 140 LEU C 1 141 GLU N -67.00 -27.00 -47.80 -47.18 -47.54 . . 0 "[ . 1 . 2]"
133 . 1 141 GLU N 1 141 GLU CA 1 141 GLU C 1 142 ALA N -67.00 -27.00 -30.04 -29.40 -29.53 . . 0 "[ . 1 . 2]"
134 . 1 142 ALA N 1 142 ALA CA 1 142 ALA C 1 143 GLU N -67.00 -27.00 -50.15 -50.19 -50.30 . . 0 "[ . 1 . 2]"
135 . 1 143 GLU N 1 143 GLU CA 1 143 GLU C 1 144 LEU N -67.00 -27.00 -26.66 -26.66 -26.67 0.51 9 0 "[ . 1 . 2]"
136 . 1 144 LEU N 1 144 LEU CA 1 144 LEU C 1 145 SER N -67.00 -27.00 -38.60 -38.49 -38.73 . . 0 "[ . 1 . 2]"
137 . 1 145 SER N 1 145 SER CA 1 145 SER C 1 146 ASP N -67.00 -27.00 -29.48 -31.09 -27.83 . . 0 "[ . 1 . 2]"
138 . 1 156 PRO N 1 156 PRO CA 1 156 PRO C 1 157 ALA N -67.00 -27.00 -26.51 -26.40 -26.41 0.62 9 0 "[ . 1 . 2]"
139 . 1 157 ALA N 1 157 ALA CA 1 157 ALA C 1 158 ILE N -67.00 -27.00 -41.00 -48.49 -36.31 . . 0 "[ . 1 . 2]"
140 . 1 158 ILE N 1 158 ILE CA 1 158 ILE C 1 159 LEU N -67.00 -27.00 -34.84 -35.37 -35.50 . . 0 "[ . 1 . 2]"
141 . 1 159 LEU N 1 159 LEU CA 1 159 LEU C 1 160 PHE N -67.00 -27.00 -37.69 -37.55 -37.72 . . 0 "[ . 1 . 2]"
142 . 1 167 ARG N 1 167 ARG CA 1 167 ARG C 1 168 LEU N -67.00 -27.00 -41.52 -45.50 -36.66 . . 0 "[ . 1 . 2]"
143 . 1 168 LEU N 1 168 LEU CA 1 168 LEU C 1 169 SER N -67.00 -27.00 -49.97 -50.68 -48.74 . . 0 "[ . 1 . 2]"
144 . 1 169 SER N 1 169 SER CA 1 169 SER C 1 170 ALA N -67.00 -27.00 -48.87 -51.16 -45.31 . . 0 "[ . 1 . 2]"
145 . 1 170 ALA N 1 170 ALA CA 1 170 ALA C 1 171 ALA N -67.00 -27.00 -40.23 -39.96 -40.00 . . 0 "[ . 1 . 2]"
146 . 1 171 ALA N 1 171 ALA CA 1 171 ALA C 1 172 ALA N -67.00 -27.00 -46.04 -45.48 -45.86 . . 0 "[ . 1 . 2]"
147 . 1 172 ALA N 1 172 ALA CA 1 172 ALA C 1 173 ALA N -67.00 -27.00 -38.03 -39.05 -36.12 . . 0 "[ . 1 . 2]"
148 . 1 173 ALA N 1 173 ALA CA 1 173 ALA C 1 174 ARG N -67.00 -27.00 -28.44 -32.28 -26.95 0.05 3 0 "[ . 1 . 2]"
149 . 1 174 ARG N 1 174 ARG CA 1 174 ARG C 1 175 LEU N -67.00 -27.00 -40.36 -41.57 -39.79 . . 0 "[ . 1 . 2]"
150 . 1 175 LEU N 1 175 LEU CA 1 175 LEU C 1 176 GLY N -67.00 -27.00 -32.25 -35.47 -29.86 . . 0 "[ . 1 . 2]"
151 . 1 179 LEU N 1 179 LEU CA 1 179 LEU C 1 180 SER N -67.00 -27.00 -26.23 -26.42 -26.09 0.91 12 0 "[ . 1 . 2]"
152 . 1 180 SER N 1 180 SER CA 1 180 SER C 1 181 LEU N -67.00 -27.00 -42.93 -45.52 -38.66 . . 0 "[ . 1 . 2]"
153 . 1 181 LEU N 1 181 LEU CA 1 181 LEU C 1 182 LEU N -67.00 -27.00 -26.70 -27.03 -26.45 0.55 5 0 "[ . 1 . 2]"
154 . 1 182 LEU N 1 182 LEU CA 1 182 LEU C 1 183 THR N -67.00 -27.00 -34.14 -31.24 -34.69 . . 0 "[ . 1 . 2]"
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