NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
395089 |
1rjv   |
6049 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1rjv
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 128
_TA_constraint_stats_list.Viol_count 447
_TA_constraint_stats_list.Viol_total 73390.55
_TA_constraint_stats_list.Viol_max 35.23
_TA_constraint_stats_list.Viol_rms 4.56
_TA_constraint_stats_list.Viol_average_all_restraints 1.59
_TA_constraint_stats_list.Viol_average_violations_only 8.64
_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 PHI 1 8 ASN C 1 9 ALA N 1 9 ALA CA 1 9 ALA C -70.00 -30.00 -51.25 -54.02 -55.31 . . 0 "[ . 1 . ]"
2 PHI 1 9 ALA C 1 10 GLU N 1 10 GLU CA 1 10 GLU C -70.00 -30.00 -62.02 -67.61 -56.18 . . 0 "[ . 1 . ]"
3 PHI 1 10 GLU C 1 11 ASP N 1 11 ASP CA 1 11 ASP C -70.00 -30.00 -69.05 -93.75 -56.53 23.75 6 3 "[ -+* 1 . ]"
4 PHI 1 11 ASP C 1 12 ILE N 1 12 ILE CA 1 12 ILE C -70.00 -30.00 -53.41 -57.27 -48.46 . . 0 "[ . 1 . ]"
5 PHI 1 12 ILE C 1 13 LYS N 1 13 LYS CA 1 13 LYS C -70.00 -30.00 -56.15 -54.90 -55.62 . . 0 "[ . 1 . ]"
6 PHI 1 13 LYS C 1 14 LYS N 1 14 LYS CA 1 14 LYS C -70.00 -30.00 -69.26 -77.92 -58.35 7.92 12 2 "[ . 1 + . - ]"
7 PHI 1 14 LYS C 1 15 ALA N 1 15 ALA CA 1 15 ALA C -70.00 -30.00 -60.38 -58.22 -58.97 . . 0 "[ . 1 . ]"
8 PHI 1 15 ALA C 1 16 VAL N 1 16 VAL CA 1 16 VAL C -70.00 -30.00 -57.06 -58.19 -58.82 . . 0 "[ . 1 . ]"
9 PHI 1 16 VAL C 1 17 GLY N 1 17 GLY CA 1 17 GLY C -70.00 -30.00 -63.80 -75.02 -59.12 5.02 16 1 "[ . 1 .+ ]"
10 PHI 1 26 ASP C 1 27 HIS N 1 27 HIS CA 1 27 HIS C -70.00 -30.00 -48.99 -53.36 -54.48 2.08 13 0 "[ . 1 . ]"
11 PHI 1 27 HIS C 1 28 LYS N 1 28 LYS CA 1 28 LYS C -70.00 -30.00 -50.87 -50.26 -53.25 . . 0 "[ . 1 . ]"
12 PHI 1 28 LYS C 1 29 LYS N 1 29 LYS CA 1 29 LYS C -80.00 -10.00 -68.75 -82.84 -55.89 2.84 5 0 "[ . 1 . ]"
13 PHI 1 29 LYS C 1 30 PHE N 1 30 PHE CA 1 30 PHE C -70.00 -30.00 -51.87 -51.35 -51.94 . . 0 "[ . 1 . ]"
14 PHI 1 30 PHE C 1 31 PHE N 1 31 PHE CA 1 31 PHE C -70.00 -30.00 -60.31 -66.43 -56.85 . . 0 "[ . 1 . ]"
15 PHI 1 31 PHE C 1 32 GLN N 1 32 GLN CA 1 32 GLN C -70.00 -30.00 -74.77 -86.82 -67.60 16.82 2 8 "[*+ - ** **. *]"
16 PHI 1 32 GLN C 1 33 MET N 1 33 MET CA 1 33 MET C -70.00 -30.00 -61.94 -73.96 -51.78 3.96 16 0 "[ . 1 . ]"
17 PHI 1 33 MET C 1 34 VAL N 1 34 VAL CA 1 34 VAL C -70.00 -30.00 -74.52 -75.35 -76.34 10.78 13 11 "[* * **-* ** + .* * ]"
18 PHI 1 35 GLY C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -70.00 -30.00 -54.71 -67.65 -47.57 . . 0 "[ . 1 . ]"
19 PHI 1 36 LEU C 1 37 LYS N 1 37 LYS CA 1 37 LYS C -70.00 -30.00 -53.43 -68.53 -47.73 . . 0 "[ . 1 . ]"
20 PHI 1 37 LYS C 1 38 LYS N 1 38 LYS CA 1 38 LYS C -70.00 -30.00 -87.79 -89.28 -91.30 29.31 7 18 [******+*******.-***]
21 PHI 1 40 SER C 1 41 ALA N 1 41 ALA CA 1 41 ALA C -70.00 -30.00 -56.17 -57.44 -58.51 . . 0 "[ . 1 . ]"
22 PHI 1 41 ALA C 1 42 ASP N 1 42 ASP CA 1 42 ASP C -70.00 -30.00 -65.47 -68.18 -71.86 9.10 7 1 "[ . + 1 . ]"
23 PHI 1 42 ASP C 1 43 ASP N 1 43 ASP CA 1 43 ASP C -70.00 -30.00 -69.30 -88.16 -54.17 18.16 7 4 "[ * . + 1 *. -]"
24 PHI 1 43 ASP C 1 44 VAL N 1 44 VAL CA 1 44 VAL C -70.00 -30.00 -49.78 -56.71 -44.63 . . 0 "[ . 1 . ]"
25 PHI 1 44 VAL C 1 45 LYS N 1 45 LYS CA 1 45 LYS C -70.00 -30.00 -55.30 -60.63 -61.76 . . 0 "[ . 1 . ]"
26 PHI 1 45 LYS C 1 46 LYS N 1 46 LYS CA 1 46 LYS C -70.00 -30.00 -71.95 -93.42 -57.48 23.42 11 7 "[ - . **1+ *** ]"
27 PHI 1 46 LYS C 1 47 VAL N 1 47 VAL CA 1 47 VAL C -70.00 -30.00 -59.89 -67.67 -49.26 . . 0 "[ . 1 . ]"
28 PHI 1 47 VAL C 1 48 PHE N 1 48 PHE CA 1 48 PHE C -70.00 -30.00 -48.69 -56.75 -42.09 . . 0 "[ . 1 . ]"
29 PHI 1 48 PHE C 1 49 HIS N 1 49 HIS CA 1 49 HIS C -70.00 -30.00 -59.15 -56.52 -56.77 . . 0 "[ . 1 . ]"
30 PHI 1 49 HIS C 1 50 MET N 1 50 MET CA 1 50 MET C -70.00 -30.00 -80.30 -69.83 -72.74 25.10 3 12 "[ + *** -1* *** ***]"
31 PHI 1 50 MET C 1 51 LEU N 1 51 LEU CA 1 51 LEU C -70.00 -30.00 -74.81 -95.33 -63.98 25.33 2 7 "[*+ *- * ** . ]"
32 PHI 1 57 GLY C 1 58 PHE N 1 58 PHE CA 1 58 PHE C -155.00 -85.00 -147.98 -159.14 -132.97 4.14 8 0 "[ . 1 . ]"
33 PHI 1 58 PHE C 1 59 ILE N 1 59 ILE CA 1 59 ILE C -155.00 -85.00 -93.80 -92.71 -98.41 13.14 18 3 "[ . 1 - * + ]"
34 PHI 1 60 GLU C 1 61 GLU N 1 61 GLU CA 1 61 GLU C -70.00 -30.00 -49.97 -48.86 -49.69 . . 0 "[ . 1 . ]"
35 PHI 1 61 GLU C 1 62 ASP N 1 62 ASP CA 1 62 ASP C -80.00 -20.00 -53.67 -55.02 -57.04 . . 0 "[ . 1 . ]"
36 PHI 1 62 ASP C 1 63 GLU N 1 63 GLU CA 1 63 GLU C -80.00 -20.00 -78.42 -100.54 -59.67 20.54 16 3 "[ - . 1 * .+ ]"
37 PHI 1 63 GLU C 1 64 LEU N 1 64 LEU CA 1 64 LEU C -70.00 -30.00 -54.99 -55.32 -56.32 . . 0 "[ . 1 . ]"
38 PHI 1 64 LEU C 1 65 GLY N 1 65 GLY CA 1 65 GLY C -70.00 -30.00 -55.83 -61.66 -69.72 3.30 12 0 "[ . 1 . ]"
39 PHI 1 66 PHE C 1 67 ILE N 1 67 ILE CA 1 67 ILE C -80.00 -20.00 -46.14 -56.84 -22.02 . . 0 "[ . 1 . ]"
40 PHI 1 67 ILE C 1 68 LEU N 1 68 LEU CA 1 68 LEU C -70.00 -30.00 -55.30 -59.30 -50.41 . . 0 "[ . 1 . ]"
41 PHI 1 68 LEU C 1 69 LYS N 1 69 LYS CA 1 69 LYS C -70.00 -30.00 -65.97 -72.81 -58.48 2.81 13 0 "[ . 1 . ]"
42 PHI 1 69 LYS C 1 70 GLY N 1 70 GLY CA 1 70 GLY C -70.00 -30.00 -83.36 -95.86 -70.37 25.86 7 16 "[******+**** **.- **]"
43 PHI 1 70 GLY C 1 71 PHE N 1 71 PHE CA 1 71 PHE C -70.00 -30.00 -64.96 -97.59 -52.65 27.59 19 4 "[ .** -1 . +]"
44 PHI 1 79 SER C 1 80 ALA N 1 80 ALA CA 1 80 ALA C -70.00 -30.00 -56.70 -60.55 -49.87 . . 0 "[ . 1 . ]"
45 PHI 1 80 ALA C 1 81 LYS N 1 81 LYS CA 1 81 LYS C -70.00 -30.00 -70.01 -63.25 -64.51 16.78 4 3 "[ +* 1 - ]"
46 PHI 1 81 LYS C 1 82 GLU N 1 82 GLU CA 1 82 GLU C -70.00 -30.00 -60.50 -62.57 -64.71 . . 0 "[ . 1 . ]"
47 PHI 1 82 GLU C 1 83 THR N 1 83 THR CA 1 83 THR C -70.00 -30.00 -50.76 -48.99 -50.43 . . 0 "[ . 1 . ]"
48 PHI 1 83 THR C 1 84 LYS N 1 84 LYS CA 1 84 LYS C -70.00 -30.00 -55.65 -62.16 -49.54 . . 0 "[ . 1 . ]"
49 PHI 1 85 MET C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -70.00 -30.00 -60.11 -60.29 -61.95 2.66 11 0 "[ . 1 . ]"
50 PHI 1 86 LEU C 1 87 MET N 1 87 MET CA 1 87 MET C -70.00 -30.00 -56.45 -56.69 -57.85 . . 0 "[ . 1 . ]"
51 PHI 1 87 MET C 1 88 ALA N 1 88 ALA CA 1 88 ALA C -70.00 -30.00 -63.54 -70.87 -58.56 0.87 2 0 "[ . 1 . ]"
52 PHI 1 88 ALA C 1 89 ALA N 1 89 ALA CA 1 89 ALA C -70.00 -30.00 -77.54 -74.88 -77.27 14.62 17 10 "[* **** - 1 * * +* ]"
53 PHI 1 89 ALA C 1 90 GLY N 1 90 GLY CA 1 90 GLY C -70.00 -30.00 -66.37 -81.51 -46.64 11.51 18 3 "[-* . 1 . + ]"
54 PHI 1 97 LYS C 1 98 ILE N 1 98 ILE CA 1 98 ILE C -155.00 -85.00 -70.54 -76.95 -78.37 24.76 3 18 "[-*+ ***************]"
55 PHI 1 98 ILE C 1 99 GLY N 1 99 GLY CA 1 99 GLY C -155.00 -85.00 -110.20 -122.54 -96.47 . . 0 "[ . 1 . ]"
56 PHI 1 99 GLY C 1 100 VAL N 1 100 VAL CA 1 100 VAL C -70.00 -30.00 -49.85 -49.31 -49.60 . . 0 "[ . 1 . ]"
57 PHI 1 101 ASP C 1 102 GLU N 1 102 GLU CA 1 102 GLU C -80.00 -20.00 -61.76 -70.22 -52.47 . . 0 "[ . 1 . ]"
58 PHI 1 102 GLU C 1 103 PHE N 1 103 PHE CA 1 103 PHE C -70.00 -30.00 -57.44 -67.87 -51.11 . . 0 "[ . 1 . ]"
59 PHI 1 103 PHE C 1 104 SER N 1 104 SER CA 1 104 SER C -70.00 -30.00 -58.65 -71.28 -50.02 1.28 10 0 "[ . 1 . ]"
60 PHI 1 105 THR C 1 106 LEU N 1 106 LEU CA 1 106 LEU C -70.00 -30.00 -43.33 -56.03 -33.12 . . 0 "[ . 1 . ]"
61 PHI 1 106 LEU C 1 107 VAL N 1 107 VAL CA 1 107 VAL C -70.00 -30.00 -89.66 -105.23 -77.08 35.23 19 19 [***-**************+]
62 PHI 1 107 VAL C 1 108 ALA N 1 108 ALA CA 1 108 ALA C -70.00 -30.00 -85.35 -73.15 -76.08 33.97 18 15 "[- **** ***** ****+ ]"
63 PHI 1 108 ALA C 1 109 GLU N 1 109 GLU CA 1 109 GLU C -70.00 -30.00 -59.88 -72.75 -50.27 2.75 14 0 "[ . 1 . ]"
64 PSI 1 9 ALA N 1 9 ALA CA 1 9 ALA C 1 10 GLU N -60.00 -20.00 -37.90 -43.57 -30.87 . . 0 "[ . 1 . ]"
65 PSI 1 10 GLU N 1 10 GLU CA 1 10 GLU C 1 11 ASP N -60.00 -20.00 -44.66 -40.00 -41.69 . . 0 "[ . 1 . ]"
66 PSI 1 11 ASP N 1 11 ASP CA 1 11 ASP C 1 12 ILE N -60.00 -20.00 -42.91 -45.53 -46.44 . . 0 "[ . 1 . ]"
67 PSI 1 12 ILE N 1 12 ILE CA 1 12 ILE C 1 13 LYS N -60.00 -20.00 -41.39 -42.27 -42.97 . . 0 "[ . 1 . ]"
68 PSI 1 13 LYS N 1 13 LYS CA 1 13 LYS C 1 14 LYS N -60.00 -20.00 -47.48 -59.05 -41.15 . . 0 "[ . 1 . ]"
69 PSI 1 14 LYS N 1 14 LYS CA 1 14 LYS C 1 15 ALA N -60.00 -20.00 -34.61 -38.58 -40.34 . . 0 "[ . 1 . ]"
70 PSI 1 15 ALA N 1 15 ALA CA 1 15 ALA C 1 16 VAL N -60.00 -20.00 -58.33 -65.54 -50.72 5.54 9 2 "[ . +1 . - ]"
71 PSI 1 16 VAL N 1 16 VAL CA 1 16 VAL C 1 17 GLY N -60.00 -20.00 -37.19 -45.03 -30.34 . . 0 "[ . 1 . ]"
72 PSI 1 17 GLY N 1 17 GLY CA 1 17 GLY C 1 18 ALA N -60.00 -20.00 -19.08 -28.99 -36.55 17.86 14 7 "[ -.*** * +.* ]"
73 PSI 1 27 HIS N 1 27 HIS CA 1 27 HIS C 1 28 LYS N -60.00 -20.00 -44.70 -35.50 -37.19 7.47 13 1 "[ . 1 + . ]"
74 PSI 1 28 LYS N 1 28 LYS CA 1 28 LYS C 1 29 LYS N -60.00 -20.00 -54.92 -42.17 -47.47 14.58 17 4 "[ . *1 .-+ *]"
75 PSI 1 29 LYS N 1 29 LYS CA 1 29 LYS C 1 30 PHE N -60.00 -20.00 -42.81 -49.84 -26.83 . . 0 "[ . 1 . ]"
76 PSI 1 30 PHE N 1 30 PHE CA 1 30 PHE C 1 31 PHE N -60.00 -20.00 -58.41 -66.38 -52.53 6.38 17 2 "[ . 1 -. + ]"
77 PSI 1 31 PHE N 1 31 PHE CA 1 31 PHE C 1 32 GLN N -60.00 -20.00 -29.37 -17.65 -18.89 2.35 2 0 "[ . 1 . ]"
78 PSI 1 32 GLN N 1 32 GLN CA 1 32 GLN C 1 33 MET N -60.00 -20.00 -51.59 -53.47 -53.99 . . 0 "[ . 1 . ]"
79 PSI 1 33 MET N 1 33 MET CA 1 33 MET C 1 34 VAL N -60.00 -20.00 -42.15 -54.83 -35.84 . . 0 "[ . 1 . ]"
80 PSI 1 34 VAL N 1 34 VAL CA 1 34 VAL C 1 35 GLY N -60.00 -20.00 -10.79 -23.32 -5.43 14.57 4 17 "[***+-****** **.****]"
81 PSI 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 LYS N -60.00 -20.00 -57.28 -58.90 -61.42 6.63 13 1 "[ . 1 + . ]"
82 PSI 1 37 LYS N 1 37 LYS CA 1 37 LYS C 1 38 LYS N -60.00 -20.00 -20.07 -7.76 -14.03 12.24 2 2 "[-+ . 1 . ]"
83 PSI 1 38 LYS N 1 38 LYS CA 1 38 LYS C 1 39 LYS N -60.00 -20.00 -18.76 -29.51 -0.59 19.41 18 3 "[ * - 1 . + ]"
84 PSI 1 42 ASP N 1 42 ASP CA 1 42 ASP C 1 43 ASP N -60.00 -20.00 -28.28 -17.59 -21.83 14.22 7 1 "[ . + 1 . ]"
85 PSI 1 43 ASP N 1 43 ASP CA 1 43 ASP C 1 44 VAL N -60.00 -20.00 -52.51 -57.79 -44.38 . . 0 "[ . 1 . ]"
86 PSI 1 44 VAL N 1 44 VAL CA 1 44 VAL C 1 45 LYS N -60.00 -20.00 -35.71 -24.24 -28.04 . . 0 "[ . 1 . ]"
87 PSI 1 45 LYS N 1 45 LYS CA 1 45 LYS C 1 46 LYS N -60.00 -20.00 -50.56 -68.07 -32.80 8.07 7 1 "[ . + 1 . ]"
88 PSI 1 46 LYS N 1 46 LYS CA 1 46 LYS C 1 47 VAL N -60.00 -20.00 -28.07 -27.49 -28.12 2.82 3 0 "[ . 1 . ]"
89 PSI 1 47 VAL N 1 47 VAL CA 1 47 VAL C 1 48 PHE N -60.00 -20.00 -64.01 -67.09 -69.40 12.84 1 6 "[+* . * ** - . ]"
90 PSI 1 48 PHE N 1 48 PHE CA 1 48 PHE C 1 49 HIS N -60.00 -20.00 -43.41 -52.51 -37.76 . . 0 "[ . 1 . ]"
91 PSI 1 49 HIS N 1 49 HIS CA 1 49 HIS C 1 50 MET N -60.00 -20.00 -22.88 -34.54 -5.60 14.40 18 4 "[ * .* 1 -. + ]"
92 PSI 1 50 MET N 1 50 MET CA 1 50 MET C 1 51 LEU N -60.00 -20.00 -32.65 -21.99 -25.43 2.66 2 0 "[ . 1 . ]"
93 PSI 1 51 LEU N 1 51 LEU CA 1 51 LEU C 1 52 ASP N -60.00 -20.00 -40.22 -41.62 -42.94 . . 0 "[ . 1 . ]"
94 PSI 1 58 PHE N 1 58 PHE CA 1 58 PHE C 1 59 ILE N 60.00 175.00 128.71 104.24 156.76 . . 0 "[ . 1 . ]"
95 PSI 1 59 ILE N 1 59 ILE CA 1 59 ILE C 1 60 GLU N 60.00 175.00 130.66 122.91 137.19 . . 0 "[ . 1 . ]"
96 PSI 1 61 GLU N 1 61 GLU CA 1 61 GLU C 1 62 ASP N -60.00 -20.00 -34.22 -38.41 -25.45 . . 0 "[ . 1 . ]"
97 PSI 1 62 ASP N 1 62 ASP CA 1 62 ASP C 1 63 GLU N -60.00 -20.00 -52.54 -61.84 -35.83 1.84 17 0 "[ . 1 . ]"
98 PSI 1 63 GLU N 1 63 GLU CA 1 63 GLU C 1 64 LEU N -60.00 -20.00 -37.41 -42.34 -43.15 . . 0 "[ . 1 . ]"
99 PSI 1 64 LEU N 1 64 LEU CA 1 64 LEU C 1 65 GLY N -60.00 -20.00 -29.81 -45.41 -11.29 8.71 10 3 "[* . + - . ]"
100 PSI 1 65 GLY N 1 65 GLY CA 1 65 GLY C 1 66 PHE N -60.00 -20.00 -29.56 -51.18 -13.10 6.90 6 1 "[ .+ 1 . ]"
101 PSI 1 67 ILE N 1 67 ILE CA 1 67 ILE C 1 68 LEU N -60.00 -20.00 -39.57 -52.38 -32.09 . . 0 "[ . 1 . ]"
102 PSI 1 68 LEU N 1 68 LEU CA 1 68 LEU C 1 69 LYS N -60.00 -20.00 -25.44 -27.97 -28.40 3.96 5 0 "[ . 1 . ]"
103 PSI 1 69 LYS N 1 69 LYS CA 1 69 LYS C 1 70 GLY N -60.00 -20.00 -11.93 -15.65 -18.04 21.70 13 12 "[ -**.****1* + .*** ]"
104 PSI 1 70 GLY N 1 70 GLY CA 1 70 GLY C 1 71 PHE N -60.00 -20.00 -37.95 -27.61 -35.34 13.77 19 2 "[ . - 1 . +]"
105 PSI 1 71 PHE N 1 71 PHE CA 1 71 PHE C 1 72 SER N -60.00 -20.00 -43.46 -37.69 -39.58 . . 0 "[ . 1 . ]"
106 PSI 1 80 ALA N 1 80 ALA CA 1 80 ALA C 1 81 LYS N -60.00 -20.00 -32.67 -35.01 -35.54 2.23 4 0 "[ . 1 . ]"
107 PSI 1 81 LYS N 1 81 LYS CA 1 81 LYS C 1 82 GLU N -60.00 -20.00 -39.39 -53.22 -30.07 . . 0 "[ . 1 . ]"
108 PSI 1 82 GLU N 1 82 GLU CA 1 82 GLU C 1 83 THR N -60.00 -20.00 -57.87 -56.55 -57.36 6.75 17 1 "[ . 1 . + ]"
109 PSI 1 83 THR N 1 83 THR CA 1 83 THR C 1 84 LYS N -60.00 -20.00 -46.16 -56.09 -37.60 . . 0 "[ . 1 . ]"
110 PSI 1 84 LYS N 1 84 LYS CA 1 84 LYS C 1 85 MET N -60.00 -20.00 -54.45 -56.32 -56.84 0.74 13 0 "[ . 1 . ]"
111 PSI 1 85 MET N 1 85 MET CA 1 85 MET C 1 86 LEU N -60.00 -20.00 -41.22 -40.12 -41.21 . . 0 "[ . 1 . ]"
112 PSI 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 MET N -60.00 -20.00 -44.53 -58.66 -32.15 . . 0 "[ . 1 . ]"
113 PSI 1 87 MET N 1 87 MET CA 1 87 MET C 1 88 ALA N -60.00 -20.00 -54.31 -64.56 -31.94 4.56 7 0 "[ . 1 . ]"
114 PSI 1 88 ALA N 1 88 ALA CA 1 88 ALA C 1 89 ALA N -60.00 -20.00 -44.52 -57.85 -31.32 . . 0 "[ . 1 . ]"
115 PSI 1 89 ALA N 1 89 ALA CA 1 89 ALA C 1 90 GLY N -60.00 -20.00 -39.15 -24.66 -28.80 7.01 18 1 "[ . 1 . + ]"
116 PSI 1 90 GLY N 1 90 GLY CA 1 90 GLY C 1 91 ASP N -60.00 -20.00 -43.60 -63.26 -17.68 3.26 6 0 "[ . 1 . ]"
117 PSI 1 98 ILE N 1 98 ILE CA 1 98 ILE C 1 99 GLY N 50.00 -175.00 124.64 129.87 127.46 . . 0 "[ . 1 . ]"
118 PSI 1 99 GLY N 1 99 GLY CA 1 99 GLY C 1 100 VAL N 60.00 175.00 151.56 136.28 164.82 . . 0 "[ . 1 . ]"
119 PSI 1 100 VAL N 1 100 VAL CA 1 100 VAL C 1 101 ASP N -60.00 -20.00 -52.49 -49.05 -50.52 10.04 8 1 "[ . + 1 . ]"
120 PSI 1 101 ASP N 1 101 ASP CA 1 101 ASP C 1 102 GLU N -60.00 -20.00 -37.55 -48.49 -23.87 . . 0 "[ . 1 . ]"
121 PSI 1 102 GLU N 1 102 GLU CA 1 102 GLU C 1 103 PHE N -70.00 -10.00 -60.37 -59.83 -60.33 5.02 18 1 "[ . 1 . + ]"
122 PSI 1 103 PHE N 1 103 PHE CA 1 103 PHE C 1 104 SER N -60.00 -20.00 -34.23 -30.69 -34.63 . . 0 "[ . 1 . ]"
123 PSI 1 104 SER N 1 104 SER CA 1 104 SER C 1 105 THR N -70.00 -10.00 -41.82 -32.26 -32.50 8.56 18 1 "[ . 1 . + ]"
124 PSI 1 105 THR N 1 105 THR CA 1 105 THR C 1 106 LEU N -60.00 -20.00 -24.33 -24.58 -25.34 4.21 18 0 "[ . 1 . ]"
125 PSI 1 106 LEU N 1 106 LEU CA 1 106 LEU C 1 107 VAL N -60.00 -20.00 -40.07 -32.86 -36.61 . . 0 "[ . 1 . ]"
126 PSI 1 107 VAL N 1 107 VAL CA 1 107 VAL C 1 108 ALA N -60.00 -20.00 -11.92 -22.08 -2.05 17.95 12 14 "[- * ** ****+ *** **]"
127 PSI 1 108 ALA N 1 108 ALA CA 1 108 ALA C 1 109 GLU N -60.00 -20.00 -37.02 -22.42 -25.52 . . 0 "[ . 1 . ]"
128 PSI 1 109 GLU N 1 109 GLU CA 1 109 GLU C 1 110 SER N -60.00 -20.00 -20.57 -13.11 -17.19 18.86 16 6 "[ - . * 1 *.+* *]"
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