Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
397470 | 1sxe RC | 5399 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1sxe
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 7
_TA_constraint_stats_list.Viol_count 14
_TA_constraint_stats_list.Viol_total 236.37
_TA_constraint_stats_list.Viol_max 2.45
_TA_constraint_stats_list.Viol_rms 0.47
_TA_constraint_stats_list.Viol_average_all_restraints 0.17
_TA_constraint_stats_list.Viol_average_violations_only 1.21
_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 23 VAL N 1 23 VAL CA 1 23 VAL CB 1 23 VAL CG1 -90.00 -30.00 -67.82 -63.28 -65.19 . . 0 "[ . 1 ]"
2 . 1 35 VAL N 1 35 VAL CA 1 35 VAL CB 1 35 VAL CG1 150.00 -150.00 148.79 149.46 149.26 2.45 11 0 "[ . 1 ]"
3 . 1 28 THR N 1 28 THR CA 1 28 THR CB 1 28 THR OG1 30.00 90.00 46.44 48.94 47.63 . . 0 "[ . 1 ]"
4 . 1 32 THR N 1 32 THR CA 1 32 THR CB 1 32 THR OG1 30.00 90.00 40.62 60.04 43.31 . . 0 "[ . 1 ]"
5 . 1 68 THR N 1 68 THR CA 1 68 THR CB 1 68 THR OG1 30.00 90.00 53.90 61.90 60.85 . . 0 "[ . 1 ]"
6 . 1 59 ILE N 1 59 ILE CA 1 59 ILE CB 1 59 ILE CG1 -90.00 -30.00 -63.25 -64.54 -65.48 . . 0 "[ . 1 ]"
7 . 1 83 ILE N 1 83 ILE CA 1 83 ILE CB 1 83 ILE CG1 -90.00 -30.00 -60.57 -57.95 -59.69 . . 0 "[ . 1 ]"
stop_
save_
save_distance_constraint_statistics_2
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 105
_TA_constraint_stats_list.Viol_count 114
_TA_constraint_stats_list.Viol_total 3035.07
_TA_constraint_stats_list.Viol_max 4.76
_TA_constraint_stats_list.Viol_rms 0.62
_TA_constraint_stats_list.Viol_average_all_restraints 0.15
_TA_constraint_stats_list.Viol_average_violations_only 1.90
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details .
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 20 ARG C 1 21 VAL N 1 21 VAL CA 1 21 VAL C -158.00 -38.00 -107.85 -137.92 -50.24 . . 0 "[ . 1 ]"
2 . 1 23 VAL C 1 24 PRO N 1 24 PRO CA 1 24 PRO C -122.00 -2.00 -58.26 -53.43 -54.61 . . 0 "[ . 1 ]"
3 . 1 24 PRO C 1 25 ALA N 1 25 ALA CA 1 25 ALA C -92.00 -32.00 -51.13 -53.53 -61.19 . . 0 "[ . 1 ]"
4 . 1 26 ASP C 1 27 PRO N 1 27 PRO CA 1 27 PRO C -121.00 -1.00 -70.69 -85.04 -61.74 . . 0 "[ . 1 ]"
5 . 1 27 PRO C 1 28 THR N 1 28 THR CA 1 28 THR C -99.00 -39.00 -97.24 -101.44 -55.78 2.44 13 0 "[ . 1 ]"
6 . 1 29 LEU C 1 30 TRP N 1 30 TRP CA 1 30 TRP C -147.00 -27.00 -55.54 -56.96 -57.19 . . 0 "[ . 1 ]"
7 . 1 30 TRP C 1 31 SER N 1 31 SER CA 1 31 SER C -121.00 -61.00 -69.18 -82.07 -60.89 0.11 11 0 "[ . 1 ]"
8 . 1 31 SER C 1 32 THR N 1 32 THR CA 1 32 THR C -93.00 -33.00 -35.19 -35.64 -36.86 0.89 3 0 "[ . 1 ]"
9 . 1 32 THR C 1 33 ASP N 1 33 ASP CA 1 33 ASP C -95.00 -35.00 -79.73 -84.95 -73.90 . . 0 "[ . 1 ]"
10 . 1 33 ASP C 1 34 HIS N 1 34 HIS CA 1 34 HIS C -93.00 -33.00 -70.33 -68.55 -69.69 . . 0 "[ . 1 ]"
11 . 1 34 HIS C 1 35 VAL N 1 35 VAL CA 1 35 VAL C -92.00 -32.00 -86.61 -88.60 -84.43 . . 0 "[ . 1 ]"
12 . 1 35 VAL C 1 36 ARG N 1 36 ARG CA 1 36 ARG C -93.00 -33.00 -67.69 -67.17 -68.36 . . 0 "[ . 1 ]"
13 . 1 36 ARG C 1 37 GLN N 1 37 GLN CA 1 37 GLN C -94.00 -34.00 -64.28 -67.62 -61.62 . . 0 "[ . 1 ]"
14 . 1 37 GLN C 1 38 TRP N 1 38 TRP CA 1 38 TRP C -97.00 -37.00 -55.14 -60.87 -48.21 . . 0 "[ . 1 ]"
15 . 1 38 TRP C 1 39 LEU N 1 39 LEU CA 1 39 LEU C -94.00 -34.00 -44.31 -46.88 -41.17 . . 0 "[ . 1 ]"
16 . 1 39 LEU C 1 40 GLU N 1 40 GLU CA 1 40 GLU C -94.00 -34.00 -78.18 -68.86 -70.74 . . 0 "[ . 1 ]"
17 . 1 40 GLU C 1 41 TRP N 1 41 TRP CA 1 41 TRP C -98.00 -38.00 -57.63 -56.79 -57.11 . . 0 "[ . 1 ]"
18 . 1 41 TRP C 1 42 ALA N 1 42 ALA CA 1 42 ALA C -91.00 -31.00 -91.79 -92.99 -89.93 1.99 13 0 "[ . 1 ]"
19 . 1 42 ALA C 1 43 VAL N 1 43 VAL CA 1 43 VAL C -96.00 -36.00 -54.31 -63.38 -48.37 . . 0 "[ . 1 ]"
20 . 1 43 VAL C 1 44 LYS N 1 44 LYS CA 1 44 LYS C -93.00 -33.00 -78.79 -69.31 -72.20 2.01 8 0 "[ . 1 ]"
21 . 1 44 LYS C 1 45 GLU N 1 45 GLU CA 1 45 GLU C -95.00 -35.00 -80.54 -89.55 -71.82 . . 0 "[ . 1 ]"
22 . 1 45 GLU C 1 46 TYR N 1 46 TYR CA 1 46 TYR C -128.00 -68.00 -106.19 -105.03 -105.93 4.01 10 0 "[ . 1 ]"
23 . 1 46 TYR C 1 47 GLY N 1 47 GLY CA 1 47 GLY C 0.00 120.00 70.95 67.15 74.00 . . 0 "[ . 1 ]"
24 . 1 48 LEU C 1 49 PRO N 1 49 PRO CA 1 49 PRO C -111.00 -21.00 -76.65 -92.98 -58.29 . . 0 "[ . 1 ]"
25 . 1 50 ASP C 1 51 VAL N 1 51 VAL CA 1 51 VAL C -135.00 -45.00 -98.08 -138.85 -81.89 3.85 2 0 "[ . 1 ]"
26 . 1 51 VAL C 1 52 ASN N 1 52 ASN CA 1 52 ASN C -118.00 -58.00 -98.57 -113.18 -93.07 . . 0 "[ . 1 ]"
27 . 1 52 ASN C 1 53 ILE N 1 53 ILE CA 1 53 ILE C -91.00 -31.00 -79.79 -90.87 -68.05 . . 0 "[ . 1 ]"
28 . 1 53 ILE C 1 54 LEU N 1 54 LEU CA 1 54 LEU C -93.00 -33.00 -62.31 -61.15 -62.96 . . 0 "[ . 1 ]"
29 . 1 54 LEU C 1 55 LEU N 1 55 LEU CA 1 55 LEU C -98.00 -38.00 -97.18 -97.72 -98.13 0.88 14 0 "[ . 1 ]"
30 . 1 55 LEU C 1 56 PHE N 1 56 PHE CA 1 56 PHE C -130.00 -70.00 -95.25 -99.72 -92.90 . . 0 "[ . 1 ]"
31 . 1 57 GLN C 1 58 ASN N 1 58 ASN CA 1 58 ASN C -151.00 -31.00 -100.73 -107.49 -94.53 . . 0 "[ . 1 ]"
32 . 1 58 ASN C 1 59 ILE N 1 59 ILE CA 1 59 ILE C -128.00 -38.00 -99.78 -104.38 -94.16 . . 0 "[ . 1 ]"
33 . 1 59 ILE C 1 60 ASP N 1 60 ASP CA 1 60 ASP C 178.00 -62.00 -93.74 -88.43 -94.06 . . 0 "[ . 1 ]"
34 . 1 60 ASP C 1 61 GLY N 1 61 GLY CA 1 61 GLY C -95.00 -35.00 -61.11 -63.52 -57.19 . . 0 "[ . 1 ]"
35 . 1 61 GLY C 1 62 LYS N 1 62 LYS CA 1 62 LYS C -94.00 -34.00 -68.75 -72.07 -66.61 . . 0 "[ . 1 ]"
36 . 1 62 LYS C 1 63 GLU N 1 63 GLU CA 1 63 GLU C -95.00 -35.00 -94.22 -92.48 -94.48 3.42 10 0 "[ . 1 ]"
37 . 1 63 GLU C 1 64 LEU N 1 64 LEU CA 1 64 LEU C -94.00 -34.00 -87.14 -90.79 -91.14 . . 0 "[ . 1 ]"
38 . 1 64 LEU C 1 65 CYS N 1 65 CYS CA 1 65 CYS C -96.00 -36.00 -71.79 -80.89 -60.89 . . 0 "[ . 1 ]"
39 . 1 67 MET C 1 68 THR N 1 68 THR CA 1 68 THR C -138.00 -78.00 -97.59 -102.43 -106.48 . . 0 "[ . 1 ]"
40 . 1 68 THR C 1 69 LYS N 1 69 LYS CA 1 69 LYS C -91.00 -31.00 -57.80 -58.61 -59.95 . . 0 "[ . 1 ]"
41 . 1 69 LYS C 1 70 ASP N 1 70 ASP CA 1 70 ASP C -94.00 -34.00 -82.35 -97.27 -67.11 3.27 13 0 "[ . 1 ]"
42 . 1 70 ASP C 1 71 ASP N 1 71 ASP CA 1 71 ASP C -94.00 -34.00 -74.63 -84.37 -67.25 . . 0 "[ . 1 ]"
43 . 1 71 ASP C 1 72 PHE N 1 72 PHE CA 1 72 PHE C -93.00 -33.00 -76.78 -80.26 -71.62 . . 0 "[ . 1 ]"
44 . 1 72 PHE C 1 73 GLN N 1 73 GLN CA 1 73 GLN C -97.00 -37.00 -73.03 -81.75 -57.78 . . 0 "[ . 1 ]"
45 . 1 73 GLN C 1 74 ARG N 1 74 ARG CA 1 74 ARG C -126.00 -6.00 -93.25 -103.96 -59.70 . . 0 "[ . 1 ]"
46 . 1 80 ASN C 1 81 ALA N 1 81 ALA CA 1 81 ALA C -93.00 -33.00 -55.34 -53.77 -53.93 . . 0 "[ . 1 ]"
47 . 1 81 ALA C 1 82 ASP N 1 82 ASP CA 1 82 ASP C -92.00 -32.00 -62.65 -66.34 -55.60 . . 0 "[ . 1 ]"
48 . 1 82 ASP C 1 83 ILE N 1 83 ILE CA 1 83 ILE C -97.00 -37.00 -70.73 -95.58 -48.04 . . 0 "[ . 1 ]"
49 . 1 83 ILE C 1 84 LEU N 1 84 LEU CA 1 84 LEU C -93.00 -33.00 -56.07 -53.47 -55.30 . . 0 "[ . 1 ]"
50 . 1 84 LEU C 1 85 LEU N 1 85 LEU CA 1 85 LEU C -94.00 -34.00 -67.15 -65.38 -65.85 . . 0 "[ . 1 ]"
51 . 1 85 LEU C 1 86 SER N 1 86 SER CA 1 86 SER C -93.00 -33.00 -65.11 -54.01 -57.76 . . 0 "[ . 1 ]"
52 . 1 86 SER C 1 87 HIS N 1 87 HIS CA 1 87 HIS C -95.00 -35.00 -78.86 -72.72 -76.87 . . 0 "[ . 1 ]"
53 . 1 87 HIS C 1 88 LEU N 1 88 LEU CA 1 88 LEU C -93.00 -33.00 -65.79 -66.17 -66.75 . . 0 "[ . 1 ]"
54 . 1 88 LEU C 1 89 HIS N 1 89 HIS CA 1 89 HIS C -92.00 -32.00 -69.89 -89.00 -55.00 . . 0 "[ . 1 ]"
55 . 1 89 HIS C 1 90 TYR N 1 90 TYR CA 1 90 TYR C -95.00 -35.00 -79.70 -96.22 -58.51 1.22 2 0 "[ . 1 ]"
56 . 1 90 TYR C 1 91 LEU N 1 91 LEU CA 1 91 LEU C -92.00 -32.00 -56.56 -55.85 -56.42 . . 0 "[ . 1 ]"
57 . 1 91 LEU C 1 92 ARG N 1 92 ARG CA 1 92 ARG C -95.00 -35.00 -74.97 -76.22 -79.10 . . 0 "[ . 1 ]"
58 . 1 92 ARG C 1 93 GLU N 1 93 GLU CA 1 93 GLU C -116.00 -56.00 -66.21 -56.61 -59.82 . . 0 "[ . 1 ]"
59 . 1 24 PRO N 1 24 PRO CA 1 24 PRO C 1 25 ALA N 80.00 -160.00 136.31 142.33 139.50 . . 0 "[ . 1 ]"
60 . 1 28 THR N 1 28 THR CA 1 28 THR C 1 29 LEU N -84.00 6.00 -35.30 -34.90 -35.62 . . 0 "[ . 1 ]"
61 . 1 30 TRP N 1 30 TRP CA 1 30 TRP C 1 31 SER N 78.00 -162.00 121.79 123.13 120.96 . . 0 "[ . 1 ]"
62 . 1 31 SER N 1 31 SER CA 1 31 SER C 1 32 THR N 108.00 -132.00 159.98 152.53 165.08 . . 0 "[ . 1 ]"
63 . 1 32 THR N 1 32 THR CA 1 32 THR C 1 33 ASP N -63.00 -3.00 -47.20 -48.91 -49.54 . . 0 "[ . 1 ]"
64 . 1 33 ASP N 1 33 ASP CA 1 33 ASP C 1 34 HIS N -71.00 -11.00 -36.00 -35.37 -36.29 . . 0 "[ . 1 ]"
65 . 1 34 HIS N 1 34 HIS CA 1 34 HIS C 1 35 VAL N -77.00 -17.00 -14.10 -15.93 -12.55 4.45 13 0 "[ . 1 ]"
66 . 1 35 VAL N 1 35 VAL CA 1 35 VAL C 1 36 ARG N -74.00 -14.00 -38.28 -40.24 -41.35 . . 0 "[ . 1 ]"
67 . 1 36 ARG N 1 36 ARG CA 1 36 ARG C 1 37 GLN N -71.00 -11.00 -27.97 -31.67 -22.76 . . 0 "[ . 1 ]"
68 . 1 37 GLN N 1 37 GLN CA 1 37 GLN C 1 38 TRP N -74.00 -14.00 -64.51 -64.93 -65.37 . . 0 "[ . 1 ]"
69 . 1 38 TRP N 1 38 TRP CA 1 38 TRP C 1 39 LEU N -72.00 -12.00 -54.70 -59.16 -50.91 . . 0 "[ . 1 ]"
70 . 1 39 LEU N 1 39 LEU CA 1 39 LEU C 1 40 GLU N -72.00 -12.00 -36.52 -42.89 -33.06 . . 0 "[ . 1 ]"
71 . 1 40 GLU N 1 40 GLU CA 1 40 GLU C 1 41 TRP N -72.00 -12.00 -53.80 -55.25 -55.36 . . 0 "[ . 1 ]"
72 . 1 41 TRP N 1 41 TRP CA 1 41 TRP C 1 42 ALA N -72.00 -12.00 -9.75 -10.99 -8.89 3.11 14 0 "[ . 1 ]"
73 . 1 42 ALA N 1 42 ALA CA 1 42 ALA C 1 43 VAL N -70.00 -10.00 -46.36 -57.74 -33.87 . . 0 "[ . 1 ]"
74 . 1 43 VAL N 1 43 VAL CA 1 43 VAL C 1 44 LYS N -70.00 -10.00 -32.44 -37.77 -22.21 . . 0 "[ . 1 ]"
75 . 1 44 LYS N 1 44 LYS CA 1 44 LYS C 1 45 GLU N -71.00 -11.00 -34.38 -47.95 -18.49 . . 0 "[ . 1 ]"
76 . 1 45 GLU N 1 45 GLU CA 1 45 GLU C 1 46 TYR N -64.00 -4.00 -40.55 -67.62 -24.49 3.62 10 0 "[ . 1 ]"
77 . 1 46 TYR N 1 46 TYR CA 1 46 TYR C 1 47 GLY N -24.00 36.00 -0.68 -7.74 8.30 . . 0 "[ . 1 ]"
78 . 1 47 GLY N 1 47 GLY CA 1 47 GLY C 1 48 LEU N -17.00 73.00 50.13 45.46 57.03 . . 0 "[ . 1 ]"
79 . 1 51 VAL N 1 51 VAL CA 1 51 VAL C 1 52 ASN N 82.00 172.00 123.76 123.98 119.33 . . 0 "[ . 1 ]"
80 . 1 56 PHE N 1 56 PHE CA 1 56 PHE C 1 57 GLN N -54.00 36.00 -8.55 -12.75 8.42 . . 0 "[ . 1 ]"
81 . 1 59 ILE N 1 59 ILE CA 1 59 ILE C 1 60 ASP N 76.00 -164.00 125.08 127.76 127.21 . . 0 "[ . 1 ]"
82 . 1 61 GLY N 1 61 GLY CA 1 61 GLY C 1 62 LYS N -65.00 -5.00 -30.18 -27.09 -30.54 . . 0 "[ . 1 ]"
83 . 1 62 LYS N 1 62 LYS CA 1 62 LYS C 1 63 GLU N -73.00 -13.00 -25.30 -28.40 -21.18 . . 0 "[ . 1 ]"
84 . 1 63 GLU N 1 63 GLU CA 1 63 GLU C 1 64 LEU N -71.00 -11.00 -26.60 -23.61 -23.94 . . 0 "[ . 1 ]"
85 . 1 64 LEU N 1 64 LEU CA 1 64 LEU C 1 65 CYS N -72.00 -12.00 -28.34 -36.16 -23.52 . . 0 "[ . 1 ]"
86 . 1 65 CYS N 1 65 CYS CA 1 65 CYS C 1 66 LYS N -67.00 -7.00 -20.39 -9.51 -22.06 0.58 9 0 "[ . 1 ]"
87 . 1 68 THR N 1 68 THR CA 1 68 THR C 1 69 LYS N 125.00 -145.00 170.87 165.30 179.29 . . 0 "[ . 1 ]"
88 . 1 69 LYS N 1 69 LYS CA 1 69 LYS C 1 70 ASP N -67.00 -7.00 -25.66 -23.96 -28.24 4.61 14 0 "[ . 1 ]"
89 . 1 70 ASP N 1 70 ASP CA 1 70 ASP C 1 71 ASP N -68.00 -8.00 -25.04 -34.05 -38.53 . . 0 "[ . 1 ]"
90 . 1 71 ASP N 1 71 ASP CA 1 71 ASP C 1 72 PHE N -72.00 -12.00 -30.72 -34.63 -22.91 . . 0 "[ . 1 ]"
91 . 1 72 PHE N 1 72 PHE CA 1 72 PHE C 1 73 GLN N -70.00 -10.00 -26.30 -26.73 -30.18 . . 0 "[ . 1 ]"
92 . 1 73 GLN N 1 73 GLN CA 1 73 GLN C 1 74 ARG N -65.00 -5.00 -12.39 -4.61 -4.68 1.57 10 0 "[ . 1 ]"
93 . 1 74 ARG N 1 74 ARG CA 1 74 ARG C 1 75 LEU N -58.00 2.00 -5.04 -0.40 -1.13 . . 0 "[ . 1 ]"
94 . 1 81 ALA N 1 81 ALA CA 1 81 ALA C 1 82 ASP N -74.00 -14.00 -52.49 -52.15 -52.21 . . 0 "[ . 1 ]"
95 . 1 82 ASP N 1 82 ASP CA 1 82 ASP C 1 83 ILE N -73.00 -13.00 -27.76 -9.47 -41.65 4.76 2 0 "[ . 1 ]"
96 . 1 83 ILE N 1 83 ILE CA 1 83 ILE C 1 84 LEU N -72.00 -12.00 -61.28 -66.42 -51.01 . . 0 "[ . 1 ]"
97 . 1 84 LEU N 1 84 LEU CA 1 84 LEU C 1 85 LEU N -71.00 -11.00 -49.57 -52.00 -53.83 . . 0 "[ . 1 ]"
98 . 1 85 LEU N 1 85 LEU CA 1 85 LEU C 1 86 SER N -73.00 -13.00 -41.42 -53.14 -19.35 . . 0 "[ . 1 ]"
99 . 1 86 SER N 1 86 SER CA 1 86 SER C 1 87 HIS N -69.00 -9.00 -28.69 -45.75 -10.49 . . 0 "[ . 1 ]"
100 . 1 87 HIS N 1 87 HIS CA 1 87 HIS C 1 88 LEU N -74.00 -14.00 -37.01 -36.39 -38.62 . . 0 "[ . 1 ]"
101 . 1 88 LEU N 1 88 LEU CA 1 88 LEU C 1 89 HIS N -71.00 -11.00 -41.09 -33.63 -35.38 . . 0 "[ . 1 ]"
102 . 1 89 HIS N 1 89 HIS CA 1 89 HIS C 1 90 TYR N -74.00 -14.00 -25.15 -13.19 -22.38 3.38 13 0 "[ . 1 ]"
103 . 1 90 TYR N 1 90 TYR CA 1 90 TYR C 1 91 LEU N -68.00 -8.00 -44.02 -51.47 -34.25 . . 0 "[ . 1 ]"
104 . 1 91 LEU N 1 91 LEU CA 1 91 LEU C 1 92 ARG N -67.00 -7.00 -43.86 -40.75 -43.61 . . 0 "[ . 1 ]"
105 . 1 92 ARG N 1 92 ARG CA 1 92 ARG C 1 93 GLU N -63.00 -3.00 -3.67 -27.90 0.64 3.64 6 0 "[ . 1 ]"
stop_
save_