NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
441373 |
2kav   |
16032 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2kav
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 126
_TA_constraint_stats_list.Viol_count 318
_TA_constraint_stats_list.Viol_total 14611.65
_TA_constraint_stats_list.Viol_max 17.70
_TA_constraint_stats_list.Viol_rms 2.04
_TA_constraint_stats_list.Viol_average_all_restraints 0.52
_TA_constraint_stats_list.Viol_average_violations_only 3.06
_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 34 ALA C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -145.00 -29.00 -75.09 -145.50 -44.65 0.50 7 0 "[ . 1 .]"
2 . 1 36 PRO C 1 37 LEU N 1 37 LEU CA 1 37 LEU C -150.00 -74.00 -93.69 -144.53 -66.46 7.54 12 1 "[ . 1 + .]"
3 . 1 37 LEU C 1 38 SER N 1 38 SER CA 1 38 SER C -124.00 -56.00 -106.44 -103.11 -104.87 0.51 4 0 "[ . 1 .]"
4 . 1 38 SER C 1 39 GLU N 1 39 GLU CA 1 39 GLU C -76.00 -44.00 -58.41 -56.81 -60.24 1.03 15 0 "[ . 1 .]"
5 . 1 39 GLU C 1 40 ASP N 1 40 ASP CA 1 40 ASP C -81.00 -49.00 -48.48 -48.43 -48.43 0.90 10 0 "[ . 1 .]"
6 . 1 40 ASP C 1 41 ASP N 1 41 ASP CA 1 41 ASP C -80.00 -52.00 -76.03 -77.73 -78.13 . . 0 "[ . 1 .]"
7 . 1 41 ASP C 1 42 PHE N 1 42 PHE CA 1 42 PHE C -77.00 -53.00 -51.04 -50.95 -51.18 2.87 4 0 "[ . 1 .]"
8 . 1 42 PHE C 1 43 GLU N 1 43 GLU CA 1 43 GLU C -70.00 -50.00 -67.36 -65.86 -66.60 0.58 10 0 "[ . 1 .]"
9 . 1 43 GLU C 1 44 MET N 1 44 MET CA 1 44 MET C -85.00 -53.00 -54.43 -56.18 -58.28 0.71 8 0 "[ . 1 .]"
10 . 1 44 MET C 1 45 PHE N 1 45 PHE CA 1 45 PHE C -81.00 -45.00 -62.97 -64.81 -61.20 . . 0 "[ . 1 .]"
11 . 1 45 PHE C 1 46 TYR N 1 46 TYR CA 1 46 TYR C -75.00 -51.00 -70.52 -73.28 -69.42 . . 0 "[ . 1 .]"
12 . 1 46 TYR C 1 47 GLU N 1 47 GLU CA 1 47 GLU C -80.00 -56.00 -60.87 -59.82 -60.49 . . 0 "[ . 1 .]"
13 . 1 47 GLU C 1 48 VAL N 1 48 VAL CA 1 48 VAL C -79.00 -55.00 -75.22 -78.06 -72.48 . . 0 "[ . 1 .]"
14 . 1 48 VAL C 1 49 TRP N 1 49 TRP CA 1 49 TRP C -75.00 -51.00 -55.99 -59.92 -53.98 . . 0 "[ . 1 .]"
15 . 1 49 TRP C 1 50 GLU N 1 50 GLU CA 1 50 GLU C -70.00 -50.00 -57.12 -65.33 -53.91 . . 0 "[ . 1 .]"
16 . 1 50 GLU C 1 51 LYS N 1 51 LYS CA 1 51 LYS C -79.00 -55.00 -69.10 -69.29 -69.83 . . 0 "[ . 1 .]"
17 . 1 54 PRO C 1 55 ASP N 1 55 ASP CA 1 55 ASP C -119.00 -49.00 -87.74 -92.17 -81.06 . . 0 "[ . 1 .]"
18 . 1 56 ALA C 1 57 THR N 1 57 THR CA 1 57 THR C -130.00 -34.00 -67.96 -69.99 -66.38 . . 0 "[ . 1 .]"
19 . 1 58 GLN C 1 59 PHE N 1 59 PHE CA 1 59 PHE C -164.00 -96.00 -129.89 -130.56 -130.76 . . 0 "[ . 1 .]"
20 . 1 59 PHE C 1 60 ILE N 1 60 ILE CA 1 60 ILE C -177.00 -101.00 -142.40 -143.46 -144.16 . . 0 "[ . 1 .]"
21 . 1 60 ILE C 1 61 GLU N 1 61 GLU CA 1 61 GLU C -121.00 -41.00 -80.40 -82.33 -78.23 . . 0 "[ . 1 .]"
22 . 1 61 GLU C 1 62 PHE N 1 62 PHE CA 1 62 PHE C -67.00 -51.00 -55.14 -58.14 -58.48 . . 0 "[ . 1 .]"
23 . 1 62 PHE C 1 63 ALA N 1 63 ALA CA 1 63 ALA C -86.00 -50.00 -56.37 -53.58 -55.26 . . 0 "[ . 1 .]"
24 . 1 63 ALA C 1 64 LYS N 1 64 LYS CA 1 64 LYS C -113.00 -65.00 -107.22 -112.03 -104.16 . . 0 "[ . 1 .]"
25 . 1 64 LYS C 1 65 LEU N 1 65 LEU CA 1 65 LEU C -70.00 -48.00 -68.81 -67.22 -68.18 0.90 5 0 "[ . 1 .]"
26 . 1 65 LEU C 1 66 SER N 1 66 SER CA 1 66 SER C -77.00 -51.00 -69.53 -77.42 -50.11 0.89 1 0 "[ . 1 .]"
27 . 1 66 SER C 1 67 ASP N 1 67 ASP CA 1 67 ASP C -74.00 -56.00 -69.88 -70.71 -71.45 . . 0 "[ . 1 .]"
28 . 1 67 ASP C 1 68 PHE N 1 68 PHE CA 1 68 PHE C -78.00 -46.00 -77.24 -83.71 -46.44 5.71 12 1 "[ . 1 + .]"
29 . 1 68 PHE C 1 69 ALA N 1 69 ALA CA 1 69 ALA C -80.00 -50.00 -49.82 -50.81 -48.85 1.15 10 0 "[ . 1 .]"
30 . 1 71 ALA C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -147.00 -31.00 -72.55 -72.53 -72.67 . . 0 "[ . 1 .]"
31 . 1 76 LEU C 1 77 LEU N 1 77 LEU CA 1 77 LEU C -178.00 -54.00 -80.54 -82.37 -76.82 . . 0 "[ . 1 .]"
32 . 1 77 LEU C 1 78 ILE N 1 78 ILE CA 1 78 ILE C -161.00 -53.00 -114.95 -112.31 -113.50 . . 0 "[ . 1 .]"
33 . 1 81 PRO C 1 82 ASN N 1 82 ASN CA 1 82 ASN C -143.00 -55.00 -123.36 -144.84 -67.91 1.84 15 0 "[ . 1 .]"
34 . 1 82 ASN C 1 83 LYS N 1 83 LYS CA 1 83 LYS C -67.00 -51.00 -81.88 -84.50 -78.78 17.50 15 15 [************-*+]
35 . 1 83 LYS C 1 84 VAL N 1 84 VAL CA 1 84 VAL C -73.00 -53.00 -62.65 -69.25 -50.58 2.42 10 0 "[ . 1 .]"
36 . 1 84 VAL C 1 85 GLN N 1 85 GLN CA 1 85 GLN C -68.00 -52.00 -55.32 -69.15 -48.18 3.82 10 0 "[ . 1 .]"
37 . 1 85 GLN C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -74.00 -50.00 -76.23 -79.83 -66.45 5.83 3 3 "[ + . 1* -.]"
38 . 1 86 LEU C 1 87 ILE N 1 87 ILE CA 1 87 ILE C -74.00 -52.00 -74.11 -74.83 -74.94 0.94 1 0 "[ . 1 .]"
39 . 1 92 PRO C 1 93 MET N 1 93 MET CA 1 93 MET C -121.00 -73.00 -108.22 -103.14 -105.58 7.93 11 1 "[ . 1+ .]"
40 . 1 93 MET C 1 94 VAL N 1 94 VAL CA 1 94 VAL C -175.00 -59.00 -96.56 -137.69 -80.29 . . 0 "[ . 1 .]"
41 . 1 94 VAL C 1 95 SER N 1 95 SER CA 1 95 SER C -170.00 2.00 -8.02 -51.77 7.58 5.58 7 1 "[ . + 1 .]"
42 . 1 97 ASP C 1 98 ARG N 1 98 ARG CA 1 98 ARG C -166.00 -74.00 -158.96 -165.36 -167.33 2.68 1 0 "[ . 1 .]"
43 . 1 98 ARG C 1 99 ILE N 1 99 ILE CA 1 99 ILE C -148.00 -104.00 -109.97 -105.82 -109.80 4.35 7 0 "[ . 1 .]"
44 . 1 99 ILE C 1 100 HIS N 1 100 HIS CA 1 100 HIS C -103.00 -39.00 -86.17 -83.22 -83.68 2.12 6 0 "[ . 1 .]"
45 . 1 100 HIS C 1 101 CYS N 1 101 CYS CA 1 101 CYS C -70.00 -46.00 -59.67 -67.05 -37.06 8.94 6 1 "[ .+ 1 .]"
46 . 1 101 CYS C 1 102 LEU N 1 102 LEU CA 1 102 LEU C -72.00 -52.00 -54.81 -72.33 -51.31 0.69 12 0 "[ . 1 .]"
47 . 1 102 LEU C 1 103 ASP N 1 103 ASP CA 1 103 ASP C -74.00 -58.00 -72.14 -70.63 -71.50 2.16 12 0 "[ . 1 .]"
48 . 1 103 ASP C 1 104 ILE N 1 104 ILE CA 1 104 ILE C -79.00 -55.00 -59.02 -58.32 -59.10 . . 0 "[ . 1 .]"
49 . 1 104 ILE C 1 105 LEU N 1 105 LEU CA 1 105 LEU C -73.00 -49.00 -62.05 -64.12 -59.20 . . 0 "[ . 1 .]"
50 . 1 105 LEU C 1 106 PHE N 1 106 PHE CA 1 106 PHE C -73.00 -57.00 -66.55 -70.12 -63.16 . . 0 "[ . 1 .]"
51 . 1 106 PHE C 1 107 ALA N 1 107 ALA CA 1 107 ALA C -70.00 -46.00 -65.98 -71.00 -53.99 1.00 9 0 "[ . 1 .]"
52 . 1 107 ALA C 1 108 PHE N 1 108 PHE CA 1 108 PHE C -83.00 -55.00 -74.99 -76.50 -73.70 . . 0 "[ . 1 .]"
53 . 1 108 PHE C 1 109 THR N 1 109 THR CA 1 109 THR C -81.00 -53.00 -75.01 -80.26 -52.02 0.98 7 0 "[ . 1 .]"
54 . 1 109 THR C 1 110 LYS N 1 110 LYS CA 1 110 LYS C -78.00 -50.00 -77.68 -79.78 -73.75 1.78 13 0 "[ . 1 .]"
55 . 1 110 LYS C 1 111 ARG N 1 111 ARG CA 1 111 ARG C -77.00 -53.00 -51.75 -52.34 -52.54 2.08 11 0 "[ . 1 .]"
56 . 1 111 ARG C 1 112 VAL N 1 112 VAL CA 1 112 VAL C -105.00 -45.00 -66.73 -38.69 -79.04 7.23 4 5 "[ - +. * 1 ** .]"
57 . 1 112 VAL C 1 113 LEU N 1 113 LEU CA 1 113 LEU C -102.00 -46.00 -99.45 -93.43 -100.77 2.88 9 0 "[ . 1 .]"
58 . 1 118 GLU C 1 119 MET N 1 119 MET CA 1 119 MET C -105.00 -41.00 -73.46 -92.76 -54.62 . . 0 "[ . 1 .]"
59 . 1 119 MET C 1 120 ASP N 1 120 ASP CA 1 120 ASP C -87.00 -43.00 -72.80 -73.54 -76.48 . . 0 "[ . 1 .]"
60 . 1 120 ASP C 1 121 ALA N 1 121 ALA CA 1 121 ALA C -105.00 -41.00 -70.86 -94.86 -47.13 . . 0 "[ . 1 .]"
61 . 1 121 ALA C 1 122 LEU N 1 122 LEU CA 1 122 LEU C -101.00 -37.00 -76.18 -96.35 -45.76 . . 0 "[ . 1 .]"
62 . 1 122 LEU C 1 123 ARG N 1 123 ARG CA 1 123 ARG C -94.00 -46.00 -76.07 -92.95 -62.35 . . 0 "[ . 1 .]"
63 . 1 123 ARG C 1 124 ILE N 1 124 ILE CA 1 124 ILE C -105.00 -37.00 -68.72 -66.00 -71.37 . . 0 "[ . 1 .]"
64 . 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 PRO N 112.00 176.00 144.91 148.37 146.56 . . 0 "[ . 1 .]"
65 . 1 37 LEU N 1 37 LEU CA 1 37 LEU C 1 38 SER N 83.00 171.00 116.90 108.88 102.34 1.24 13 0 "[ . 1 .]"
66 . 1 38 SER N 1 38 SER CA 1 38 SER C 1 39 GLU N 151.00 179.00 172.47 150.35 179.59 0.65 4 0 "[ . 1 .]"
67 . 1 39 GLU N 1 39 GLU CA 1 39 GLU C 1 40 ASP N -54.00 -22.00 -34.13 -32.48 -36.32 . . 0 "[ . 1 .]"
68 . 1 40 ASP N 1 40 ASP CA 1 40 ASP C 1 41 ASP N -60.00 -24.00 -30.24 -34.47 -27.49 . . 0 "[ . 1 .]"
69 . 1 41 ASP N 1 41 ASP CA 1 41 ASP C 1 42 PHE N -53.00 -25.00 -43.64 -45.80 -42.09 . . 0 "[ . 1 .]"
70 . 1 42 PHE N 1 42 PHE CA 1 42 PHE C 1 43 GLU N -50.00 -30.00 -49.30 -49.32 -49.62 0.18 1 0 "[ . 1 .]"
71 . 1 43 GLU N 1 43 GLU CA 1 43 GLU C 1 44 MET N -52.00 -36.00 -50.36 -53.96 -43.13 1.96 10 0 "[ . 1 .]"
72 . 1 44 MET N 1 44 MET CA 1 44 MET C 1 45 PHE N -52.00 -28.00 -35.92 -37.35 -34.02 . . 0 "[ . 1 .]"
73 . 1 45 PHE N 1 45 PHE CA 1 45 PHE C 1 46 TYR N -56.00 -32.00 -40.79 -42.38 -38.44 . . 0 "[ . 1 .]"
74 . 1 46 TYR N 1 46 TYR CA 1 46 TYR C 1 47 GLU N -52.00 -24.00 -31.65 -33.61 -30.52 . . 0 "[ . 1 .]"
75 . 1 47 GLU N 1 47 GLU CA 1 47 GLU C 1 48 VAL N -51.00 -23.00 -42.80 -41.65 -43.27 . . 0 "[ . 1 .]"
76 . 1 48 VAL N 1 48 VAL CA 1 48 VAL C 1 49 TRP N -56.00 -24.00 -38.60 -39.00 -38.15 . . 0 "[ . 1 .]"
77 . 1 49 TRP N 1 49 TRP CA 1 49 TRP C 1 50 GLU N -51.00 -35.00 -42.19 -43.03 -43.27 . . 0 "[ . 1 .]"
78 . 1 50 GLU N 1 50 GLU CA 1 50 GLU C 1 51 LYS N -60.00 -16.00 -29.09 -29.92 -30.04 . . 0 "[ . 1 .]"
79 . 1 51 LYS N 1 51 LYS CA 1 51 LYS C 1 52 PHE N -48.00 -24.00 -33.96 -36.02 -27.33 . . 0 "[ . 1 .]"
80 . 1 55 ASP N 1 55 ASP CA 1 55 ASP C 1 56 ALA N -43.00 37.00 -7.41 -6.48 -6.96 . . 0 "[ . 1 .]"
81 . 1 57 THR N 1 57 THR CA 1 57 THR C 1 58 GLN N -63.00 19.00 -31.95 -31.56 -31.75 . . 0 "[ . 1 .]"
82 . 1 59 PHE N 1 59 PHE CA 1 59 PHE C 1 60 ILE N 128.00 180.00 153.66 149.68 156.76 . . 0 "[ . 1 .]"
83 . 1 60 ILE N 1 60 ILE CA 1 60 ILE C 1 61 GLU N 130.00 174.00 147.40 145.71 149.61 . . 0 "[ . 1 .]"
84 . 1 61 GLU N 1 61 GLU CA 1 61 GLU C 1 62 PHE N 113.00 -179.00 140.16 144.27 143.43 . . 0 "[ . 1 .]"
85 . 1 62 PHE N 1 62 PHE CA 1 62 PHE C 1 63 ALA N -59.00 -13.00 -44.97 -43.96 -44.28 . . 0 "[ . 1 .]"
86 . 1 63 ALA N 1 63 ALA CA 1 63 ALA C 1 64 LYS N -42.00 -14.00 -23.63 -25.32 -22.58 . . 0 "[ . 1 .]"
87 . 1 64 LYS N 1 64 LYS CA 1 64 LYS C 1 65 LEU N -38.00 16.00 0.72 -0.39 -2.23 . . 0 "[ . 1 .]"
88 . 1 65 LEU N 1 65 LEU CA 1 65 LEU C 1 66 SER N -57.00 -19.00 -29.47 -33.20 -48.71 . . 0 "[ . 1 .]"
89 . 1 66 SER N 1 66 SER CA 1 66 SER C 1 67 ASP N -55.00 -23.00 -35.04 -35.71 -34.21 . . 0 "[ . 1 .]"
90 . 1 67 ASP N 1 67 ASP CA 1 67 ASP C 1 68 PHE N -58.00 -16.00 -28.95 -26.37 -60.55 2.71 1 0 "[ . 1 .]"
91 . 1 68 PHE N 1 68 PHE CA 1 68 PHE C 1 69 ALA N -61.00 -31.00 -47.48 -48.83 -43.72 . . 0 "[ . 1 .]"
92 . 1 69 ALA N 1 69 ALA CA 1 69 ALA C 1 70 ASP N -59.00 -5.00 -37.25 -38.32 -35.87 . . 0 "[ . 1 .]"
93 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 ASP N 88.00 -154.00 168.45 168.75 168.35 . . 0 "[ . 1 .]"
94 . 1 77 LEU N 1 77 LEU CA 1 77 LEU C 1 78 ILE N 76.00 -166.00 124.52 121.53 128.78 . . 0 "[ . 1 .]"
95 . 1 78 ILE N 1 78 ILE CA 1 78 ILE C 1 79 ALA N 86.00 156.00 104.52 100.35 107.34 . . 0 "[ . 1 .]"
96 . 1 82 ASN N 1 82 ASN CA 1 82 ASN C 1 83 LYS N 82.00 -136.00 67.72 64.30 70.60 17.70 15 15 [*********-****+]
97 . 1 83 LYS N 1 83 LYS CA 1 83 LYS C 1 84 VAL N -51.00 -25.00 -32.53 -37.50 -29.73 . . 0 "[ . 1 .]"
98 . 1 84 VAL N 1 84 VAL CA 1 84 VAL C 1 85 GLN N -54.00 -32.00 -43.78 -48.21 -48.85 0.58 3 0 "[ . 1 .]"
99 . 1 85 GLN N 1 85 GLN CA 1 85 GLN C 1 86 LEU N -55.00 -27.00 -28.77 -33.20 -25.62 1.38 1 0 "[ . 1 .]"
100 . 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 ILE N -56.00 -28.00 -36.59 -35.60 -36.10 . . 0 "[ . 1 .]"
101 . 1 87 ILE N 1 87 ILE CA 1 87 ILE C 1 88 ALA N -58.00 -14.00 -39.69 -43.10 -34.18 . . 0 "[ . 1 .]"
102 . 1 93 MET N 1 93 MET CA 1 93 MET C 1 94 VAL N 111.00 171.00 134.63 132.62 131.74 4.31 11 0 "[ . 1 .]"
103 . 1 94 VAL N 1 94 VAL CA 1 94 VAL C 1 95 SER N 122.00 -178.00 -177.98 161.57 -171.64 6.36 7 1 "[ . + 1 .]"
104 . 1 95 SER N 1 95 SER CA 1 95 SER C 1 96 GLY N 113.00 153.00 113.83 108.49 125.99 4.51 11 0 "[ . 1 .]"
105 . 1 98 ARG N 1 98 ARG CA 1 98 ARG C 1 99 ILE N 107.00 -177.00 151.16 126.69 -175.41 1.59 13 0 "[ . 1 .]"
106 . 1 99 ILE N 1 99 ILE CA 1 99 ILE C 1 100 HIS N 107.00 167.00 149.96 132.26 168.11 1.11 11 0 "[ . 1 .]"
107 . 1 100 HIS N 1 100 HIS CA 1 100 HIS C 1 101 CYS N 106.00 162.00 124.39 121.14 151.61 . . 0 "[ . 1 .]"
108 . 1 101 CYS N 1 101 CYS CA 1 101 CYS C 1 102 LEU N -59.00 -31.00 -38.73 -36.54 -40.74 0.82 6 0 "[ . 1 .]"
109 . 1 102 LEU N 1 102 LEU CA 1 102 LEU C 1 103 ASP N -53.00 -25.00 -38.96 -43.98 -35.34 . . 0 "[ . 1 .]"
110 . 1 103 ASP N 1 103 ASP CA 1 103 ASP C 1 104 ILE N -50.00 -26.00 -43.35 -44.89 -45.00 . . 0 "[ . 1 .]"
111 . 1 104 ILE N 1 104 ILE CA 1 104 ILE C 1 105 LEU N -50.00 -34.00 -44.54 -46.15 -41.08 . . 0 "[ . 1 .]"
112 . 1 105 LEU N 1 105 LEU CA 1 105 LEU C 1 106 PHE N -55.00 -31.00 -49.89 -50.73 -48.59 . . 0 "[ . 1 .]"
113 . 1 106 PHE N 1 106 PHE CA 1 106 PHE C 1 107 ALA N -50.00 -30.00 -39.70 -47.04 -50.72 1.62 1 0 "[ . 1 .]"
114 . 1 107 ALA N 1 107 ALA CA 1 107 ALA C 1 108 PHE N -56.00 -32.00 -38.65 -42.42 -35.47 . . 0 "[ . 1 .]"
115 . 1 108 PHE N 1 108 PHE CA 1 108 PHE C 1 109 THR N -59.00 -23.00 -26.24 -22.84 -25.03 1.48 2 0 "[ . 1 .]"
116 . 1 109 THR N 1 109 THR CA 1 109 THR C 1 110 LYS N -49.00 -37.00 -33.31 -34.80 -35.65 5.20 6 2 "[ -.+ 1 .]"
117 . 1 110 LYS N 1 110 LYS CA 1 110 LYS C 1 111 ARG N -52.00 -32.00 -46.25 -47.31 -48.61 . . 0 "[ . 1 .]"
118 . 1 111 ARG N 1 111 ARG CA 1 111 ARG C 1 112 VAL N -51.00 -19.00 -41.39 -41.44 -41.52 . . 0 "[ . 1 .]"
119 . 1 112 VAL N 1 112 VAL CA 1 112 VAL C 1 113 LEU N -55.00 -19.00 -25.76 -50.01 -12.72 6.28 6 2 "[ .+ 1- .]"
120 . 1 113 LEU N 1 113 LEU CA 1 113 LEU C 1 114 GLY N -66.00 14.00 -22.91 -41.95 -5.48 . . 0 "[ . 1 .]"
121 . 1 119 MET N 1 119 MET CA 1 119 MET C 1 120 ASP N -82.00 30.00 -19.71 -33.92 1.62 . . 0 "[ . 1 .]"
122 . 1 120 ASP N 1 120 ASP CA 1 120 ASP C 1 121 ALA N -63.00 -15.00 -19.98 -18.68 -20.83 0.17 5 0 "[ . 1 .]"
123 . 1 121 ALA N 1 121 ALA CA 1 121 ALA C 1 122 LEU N -80.00 32.00 -26.16 -47.13 2.10 . . 0 "[ . 1 .]"
124 . 1 122 LEU N 1 122 LEU CA 1 122 LEU C 1 123 ARG N -76.00 16.00 -27.23 -31.06 -33.31 . . 0 "[ . 1 .]"
125 . 1 123 ARG N 1 123 ARG CA 1 123 ARG C 1 124 ILE N -78.00 14.00 -30.71 14.09 -2.94 0.09 2 0 "[ . 1 .]"
126 . 1 124 ILE N 1 124 ILE CA 1 124 ILE C 1 125 GLN N -86.00 18.00 -28.76 1.12 -12.10 . . 0 "[ . 1 .]"
stop_
save_
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