NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
516075 |
1cmz   |
4407 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1cmz
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 146
_TA_constraint_stats_list.Viol_count 126
_TA_constraint_stats_list.Viol_total 2205.50
_TA_constraint_stats_list.Viol_max 3.87
_TA_constraint_stats_list.Viol_rms 0.23
_TA_constraint_stats_list.Viol_average_all_restraints 0.04
_TA_constraint_stats_list.Viol_average_violations_only 0.88
_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 13 SER C 1 14 PRO N 1 14 PRO CA 1 14 PRO C -98.29 -18.29 -52.78 -51.84 -52.24 . . 0 "[ . 1 . 2]"
2 . 1 14 PRO C 1 15 GLU N 1 15 GLU CA 1 15 GLU C -84.12 -44.12 -79.84 -71.91 -79.99 1.27 6 0 "[ . 1 . 2]"
3 . 1 15 GLU C 1 16 GLU N 1 16 GLU CA 1 16 GLU C -86.09 -46.09 -77.86 -53.78 -57.20 2.42 15 0 "[ . 1 . 2]"
4 . 1 16 GLU C 1 17 VAL N 1 17 VAL CA 1 17 VAL C -83.73 -43.73 -77.74 -83.76 -70.38 0.03 9 0 "[ . 1 . 2]"
5 . 1 17 VAL C 1 18 GLN N 1 18 GLN CA 1 18 GLN C -83.64 -43.64 -70.73 -68.58 -69.41 0.92 9 0 "[ . 1 . 2]"
6 . 1 18 GLN C 1 19 SER N 1 19 SER CA 1 19 SER C -84.74 -44.74 -82.75 -85.56 -66.45 0.82 9 0 "[ . 1 . 2]"
7 . 1 19 SER C 1 20 TRP N 1 20 TRP CA 1 20 TRP C -86.26 -46.26 -65.84 -69.13 -70.17 . . 0 "[ . 1 . 2]"
8 . 1 24 PHE C 1 25 ASP N 1 25 ASP CA 1 25 ASP C -79.18 -39.18 -49.68 -58.52 -44.82 . . 0 "[ . 1 . 2]"
9 . 1 25 ASP C 1 26 LYS N 1 26 LYS CA 1 26 LYS C -84.66 -44.66 -47.23 -45.17 -46.00 0.84 18 0 "[ . 1 . 2]"
10 . 1 26 LYS C 1 27 LEU N 1 27 LEU CA 1 27 LEU C -83.60 -43.60 -73.23 -73.17 -73.93 0.01 17 0 "[ . 1 . 2]"
11 . 1 27 LEU C 1 28 MET N 1 28 MET CA 1 28 MET C -105.50 -25.50 -99.63 -95.62 -95.80 3.50 6 0 "[ . 1 . 2]"
12 . 1 31 PRO C 1 32 ALA N 1 32 ALA CA 1 32 ALA C -78.11 -38.11 -72.31 -81.98 -63.98 3.87 18 0 "[ . 1 . 2]"
13 . 1 32 ALA C 1 33 GLY N 1 33 GLY CA 1 33 GLY C -81.90 -41.90 -62.40 -63.92 -64.74 . . 0 "[ . 1 . 2]"
14 . 1 33 GLY C 1 34 ARG N 1 34 ARG CA 1 34 ARG C -104.44 -24.44 -44.26 -48.22 -41.96 . . 0 "[ . 1 . 2]"
15 . 1 34 ARG C 1 35 SER N 1 35 SER CA 1 35 SER C -99.53 -19.53 -80.33 -83.97 -77.75 . . 0 "[ . 1 . 2]"
16 . 1 35 SER C 1 36 VAL N 1 36 VAL CA 1 36 VAL C -84.06 -44.06 -55.47 -64.08 -48.76 . . 0 "[ . 1 . 2]"
17 . 1 36 VAL C 1 37 PHE N 1 37 PHE CA 1 37 PHE C -83.03 -43.03 -66.31 -65.97 -66.67 . . 0 "[ . 1 . 2]"
18 . 1 37 PHE C 1 38 ARG N 1 38 ARG CA 1 38 ARG C -80.96 -40.96 -62.26 -67.88 -57.32 . . 0 "[ . 1 . 2]"
19 . 1 38 ARG C 1 39 ALA N 1 39 ALA CA 1 39 ALA C -102.81 -22.81 -80.60 -83.28 -76.93 . . 0 "[ . 1 . 2]"
20 . 1 39 ALA C 1 40 PHE N 1 40 PHE CA 1 40 PHE C -101.43 -21.43 -45.57 -44.45 -44.79 . . 0 "[ . 1 . 2]"
21 . 1 40 PHE C 1 41 LEU N 1 41 LEU CA 1 41 LEU C -85.13 -45.13 -56.27 -62.02 -53.72 . . 0 "[ . 1 . 2]"
22 . 1 41 LEU C 1 42 ARG N 1 42 ARG CA 1 42 ARG C -80.90 -40.90 -45.68 -54.51 -42.31 . . 0 "[ . 1 . 2]"
23 . 1 42 ARG C 1 43 THR N 1 43 THR CA 1 43 THR C -87.26 -47.26 -59.63 -66.42 -54.11 . . 0 "[ . 1 . 2]"
24 . 1 43 THR C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -131.48 -51.48 -64.18 -99.89 -50.19 1.29 14 0 "[ . 1 . 2]"
25 . 1 46 SER C 1 47 GLU N 1 47 GLU CA 1 47 GLU C -98.17 -18.17 -81.54 -87.43 -88.48 0.52 5 0 "[ . 1 . 2]"
26 . 1 47 GLU C 1 48 GLU N 1 48 GLU CA 1 48 GLU C -82.90 -42.90 -45.70 -42.46 -42.80 1.74 19 0 "[ . 1 . 2]"
27 . 1 48 GLU C 1 49 ASN N 1 49 ASN CA 1 49 ASN C -83.29 -43.29 -61.77 -82.98 -45.13 . . 0 "[ . 1 . 2]"
28 . 1 49 ASN C 1 50 MET N 1 50 MET CA 1 50 MET C -85.91 -45.91 -60.72 -81.02 -48.88 . . 0 "[ . 1 . 2]"
29 . 1 50 MET C 1 51 LEU N 1 51 LEU CA 1 51 LEU C -86.33 -46.33 -55.50 -56.53 -57.81 0.25 13 0 "[ . 1 . 2]"
30 . 1 51 LEU C 1 52 PHE N 1 52 PHE CA 1 52 PHE C -81.28 -41.28 -49.08 -47.56 -48.18 . . 0 "[ . 1 . 2]"
31 . 1 52 PHE C 1 53 TRP N 1 53 TRP CA 1 53 TRP C -83.90 -43.90 -74.29 -82.15 -56.30 . . 0 "[ . 1 . 2]"
32 . 1 53 TRP C 1 54 LEU N 1 54 LEU CA 1 54 LEU C -79.90 -39.90 -65.24 -69.21 -57.74 . . 0 "[ . 1 . 2]"
33 . 1 54 LEU C 1 55 ALA N 1 55 ALA CA 1 55 ALA C -81.53 -41.53 -54.84 -54.48 -55.69 . . 0 "[ . 1 . 2]"
34 . 1 55 ALA C 1 56 CYS N 1 56 CYS CA 1 56 CYS C -83.04 -43.04 -69.46 -77.29 -54.77 . . 0 "[ . 1 . 2]"
35 . 1 56 CYS C 1 57 GLU N 1 57 GLU CA 1 57 GLU C -86.19 -46.19 -70.42 -79.91 -81.06 . . 0 "[ . 1 . 2]"
36 . 1 57 GLU C 1 58 GLU N 1 58 GLU CA 1 58 GLU C -99.26 -19.26 -75.07 -79.72 -84.61 . . 0 "[ . 1 . 2]"
37 . 1 58 GLU C 1 59 LEU N 1 59 LEU CA 1 59 LEU C -82.01 -42.01 -54.91 -66.06 -42.31 . . 0 "[ . 1 . 2]"
38 . 1 59 LEU C 1 60 LYS N 1 60 LYS CA 1 60 LYS C -104.87 -24.87 -81.82 -93.90 -71.15 . . 0 "[ . 1 . 2]"
39 . 1 65 GLN C 1 66 HIS N 1 66 HIS CA 1 66 HIS C -104.40 -24.40 -87.74 -105.89 -62.66 1.49 2 0 "[ . 1 . 2]"
40 . 1 66 HIS C 1 67 VAL N 1 67 VAL CA 1 67 VAL C -106.95 -26.95 -80.52 -94.05 -70.68 . . 0 "[ . 1 . 2]"
41 . 1 67 VAL C 1 68 VAL N 1 68 VAL CA 1 68 VAL C -80.23 -40.23 -64.56 -73.87 -58.82 . . 0 "[ . 1 . 2]"
42 . 1 69 ASP C 1 70 GLU N 1 70 GLU CA 1 70 GLU C -80.97 -40.97 -56.26 -70.50 -44.66 . . 0 "[ . 1 . 2]"
43 . 1 70 GLU C 1 71 LYS N 1 71 LYS CA 1 71 LYS C -83.80 -43.80 -62.37 -68.60 -55.12 . . 0 "[ . 1 . 2]"
44 . 1 71 LYS C 1 72 ALA N 1 72 ALA CA 1 72 ALA C -101.73 -21.73 -50.18 -47.89 -48.39 . . 0 "[ . 1 . 2]"
45 . 1 72 ALA C 1 73 ARG N 1 73 ARG CA 1 73 ARG C -85.28 -45.28 -73.50 -68.60 -69.11 . . 0 "[ . 1 . 2]"
46 . 1 73 ARG C 1 74 LEU N 1 74 LEU CA 1 74 LEU C -104.29 -24.29 -44.64 -51.73 -41.35 . . 0 "[ . 1 . 2]"
47 . 1 74 LEU C 1 75 ILE N 1 75 ILE CA 1 75 ILE C -84.84 -44.84 -66.54 -60.29 -62.59 . . 0 "[ . 1 . 2]"
48 . 1 75 ILE C 1 76 TYR N 1 76 TYR CA 1 76 TYR C -82.49 -42.49 -63.32 -64.61 -65.24 . . 0 "[ . 1 . 2]"
49 . 1 76 TYR C 1 77 GLU N 1 77 GLU CA 1 77 GLU C -81.48 -41.48 -66.66 -83.39 -52.17 1.91 11 0 "[ . 1 . 2]"
50 . 1 77 GLU C 1 78 ASP N 1 78 ASP CA 1 78 ASP C -84.72 -44.72 -68.70 -84.73 -56.82 0.01 11 0 "[ . 1 . 2]"
51 . 1 92 SER C 1 93 ARG N 1 93 ARG CA 1 93 ARG C -83.59 -43.59 -53.07 -46.89 -47.37 . . 0 "[ . 1 . 2]"
52 . 1 93 ARG C 1 94 VAL N 1 94 VAL CA 1 94 VAL C -83.45 -43.45 -61.52 -69.20 -72.88 . . 0 "[ . 1 . 2]"
53 . 1 94 VAL C 1 95 ARG N 1 95 ARG CA 1 95 ARG C -84.11 -44.11 -56.91 -55.18 -56.80 . . 0 "[ . 1 . 2]"
54 . 1 95 ARG C 1 96 GLU N 1 96 GLU CA 1 96 GLU C -83.61 -43.61 -82.35 -82.42 -82.66 1.82 7 0 "[ . 1 . 2]"
55 . 1 96 GLU C 1 97 GLY N 1 97 GLY CA 1 97 GLY C -82.49 -42.49 -61.05 -80.09 -51.75 . . 0 "[ . 1 . 2]"
56 . 1 97 GLY C 1 98 ILE N 1 98 ILE CA 1 98 ILE C -103.54 -23.54 -73.45 -67.96 -69.19 . . 0 "[ . 1 . 2]"
57 . 1 98 ILE C 1 99 ASN N 1 99 ASN CA 1 99 ASN C -101.38 -21.38 -68.51 -66.22 -67.44 . . 0 "[ . 1 . 2]"
58 . 1 99 ASN C 1 100 LYS N 1 100 LYS CA 1 100 LYS C -106.36 -26.36 -92.95 -105.70 -81.75 . . 0 "[ . 1 . 2]"
59 . 1 100 LYS C 1 101 LYS N 1 101 LYS CA 1 101 LYS C -113.14 -33.14 -81.06 -81.14 -82.29 . . 0 "[ . 1 . 2]"
60 . 1 111 ASP C 1 112 ASP N 1 112 ASP CA 1 112 ASP C -99.96 -19.96 -53.24 -69.72 -83.83 . . 0 "[ . 1 . 2]"
61 . 1 112 ASP C 1 113 ALA N 1 113 ALA CA 1 113 ALA C -83.21 -43.21 -68.82 -74.85 -58.36 . . 0 "[ . 1 . 2]"
62 . 1 113 ALA C 1 114 GLN N 1 114 GLN CA 1 114 GLN C -85.63 -45.63 -57.52 -64.52 -53.34 . . 0 "[ . 1 . 2]"
63 . 1 114 GLN C 1 115 LEU N 1 115 LEU CA 1 115 LEU C -84.29 -44.29 -80.01 -85.01 -58.14 0.72 10 0 "[ . 1 . 2]"
64 . 1 115 LEU C 1 116 GLN N 1 116 GLN CA 1 116 GLN C -101.63 -21.63 -47.29 -45.35 -45.94 . . 0 "[ . 1 . 2]"
65 . 1 116 GLN C 1 117 ILE N 1 117 ILE CA 1 117 ILE C -86.57 -46.57 -70.44 -72.33 -66.88 . . 0 "[ . 1 . 2]"
66 . 1 117 ILE C 1 118 TYR N 1 118 TYR CA 1 118 TYR C -84.70 -44.70 -49.84 -60.35 -44.56 0.14 11 0 "[ . 1 . 2]"
67 . 1 118 TYR C 1 119 THR N 1 119 THR CA 1 119 THR C -104.58 -24.58 -80.44 -85.49 -74.80 . . 0 "[ . 1 . 2]"
68 . 1 119 THR C 1 120 LEU N 1 120 LEU CA 1 120 LEU C -85.16 -45.16 -61.77 -62.50 -62.99 . . 0 "[ . 1 . 2]"
69 . 1 120 LEU C 1 121 MET N 1 121 MET CA 1 121 MET C -83.95 -43.95 -65.22 -66.91 -68.22 . . 0 "[ . 1 . 2]"
70 . 1 121 MET C 1 122 HIS N 1 122 HIS CA 1 122 HIS C -84.66 -44.66 -57.33 -52.09 -54.23 . . 0 "[ . 1 . 2]"
71 . 1 122 HIS C 1 123 ARG N 1 123 ARG CA 1 123 ARG C -105.93 -25.93 -89.69 -84.04 -88.37 . . 0 "[ . 1 . 2]"
72 . 1 124 ASP C 1 125 SER N 1 125 SER CA 1 125 SER C -107.26 -27.26 -93.51 -95.11 -95.79 . . 0 "[ . 1 . 2]"
73 . 1 125 SER C 1 126 TYR N 1 126 TYR CA 1 126 TYR C -87.26 -47.26 -64.28 -68.25 -59.20 . . 0 "[ . 1 . 2]"
74 . 1 126 TYR C 1 127 PRO N 1 127 PRO CA 1 127 PRO C -99.97 -19.97 -58.30 -58.85 -59.91 . . 0 "[ . 1 . 2]"
75 . 1 127 PRO C 1 128 ARG N 1 128 ARG CA 1 128 ARG C -107.85 -27.85 -95.00 -100.16 -90.19 . . 0 "[ . 1 . 2]"
76 . 1 128 ARG C 1 129 PHE N 1 129 PHE CA 1 129 PHE C -103.47 -23.47 -51.59 -61.33 -45.47 . . 0 "[ . 1 . 2]"
77 . 1 129 PHE C 1 130 LEU N 1 130 LEU CA 1 130 LEU C -86.06 -46.06 -59.56 -67.64 -51.38 . . 0 "[ . 1 . 2]"
78 . 1 133 PRO C 1 134 THR N 1 134 THR CA 1 134 THR C -83.00 -43.00 -52.59 -51.59 -52.38 . . 0 "[ . 1 . 2]"
79 . 1 134 THR C 1 135 TYR N 1 135 TYR CA 1 135 TYR C -105.41 -25.41 -97.89 -99.30 -100.10 . . 0 "[ . 1 . 2]"
80 . 1 135 TYR C 1 136 ARG N 1 136 ARG CA 1 136 ARG C -104.65 -24.65 -90.14 -94.24 -86.75 . . 0 "[ . 1 . 2]"
81 . 1 136 ARG C 1 137 ALA N 1 137 ALA CA 1 137 ALA C -109.30 -29.30 -88.22 -96.39 -67.58 . . 0 "[ . 1 . 2]"
82 . 1 14 PRO N 1 14 PRO CA 1 14 PRO C 1 15 GLU N -75.65 4.35 -5.20 -22.35 1.52 . . 0 "[ . 1 . 2]"
83 . 1 15 GLU N 1 15 GLU CA 1 15 GLU C 1 16 GLU N -62.92 -22.92 -33.87 -57.63 -21.58 1.34 9 0 "[ . 1 . 2]"
84 . 1 16 GLU N 1 16 GLU CA 1 16 GLU C 1 17 VAL N -61.77 -21.77 -35.64 -43.78 -32.09 . . 0 "[ . 1 . 2]"
85 . 1 17 VAL N 1 17 VAL CA 1 17 VAL C 1 18 GLN N -63.00 -23.00 -46.56 -52.60 -53.09 2.04 19 0 "[ . 1 . 2]"
86 . 1 18 GLN N 1 18 GLN CA 1 18 GLN C 1 19 SER N -61.22 -21.22 -31.09 -26.95 -28.14 . . 0 "[ . 1 . 2]"
87 . 1 19 SER N 1 19 SER CA 1 19 SER C 1 20 TRP N -58.65 -18.65 -37.65 -39.87 -42.89 . . 0 "[ . 1 . 2]"
88 . 1 20 TRP N 1 20 TRP CA 1 20 TRP C 1 21 ALA N -42.51 -2.51 -24.80 -34.00 -9.55 . . 0 "[ . 1 . 2]"
89 . 1 32 ALA N 1 32 ALA CA 1 32 ALA C 1 33 GLY N -63.58 -23.58 -28.79 -31.42 -20.47 3.11 18 0 "[ . 1 . 2]"
90 . 1 33 GLY N 1 33 GLY CA 1 33 GLY C 1 34 ARG N -82.10 -2.10 -66.33 -60.69 -61.36 . . 0 "[ . 1 . 2]"
91 . 1 34 ARG N 1 34 ARG CA 1 34 ARG C 1 35 SER N -83.34 -3.34 -17.69 -21.09 -12.48 . . 0 "[ . 1 . 2]"
92 . 1 35 SER N 1 35 SER CA 1 35 SER C 1 36 VAL N -66.57 -26.57 -59.10 -58.30 -59.98 . . 0 "[ . 1 . 2]"
93 . 1 36 VAL N 1 36 VAL CA 1 36 VAL C 1 37 PHE N -60.27 -20.27 -40.17 -43.53 -33.05 . . 0 "[ . 1 . 2]"
94 . 1 37 PHE N 1 37 PHE CA 1 37 PHE C 1 38 ARG N -61.36 -21.36 -37.54 -37.25 -37.71 . . 0 "[ . 1 . 2]"
95 . 1 38 ARG N 1 38 ARG CA 1 38 ARG C 1 39 ALA N -62.35 -22.35 -30.90 -30.26 -30.39 . . 0 "[ . 1 . 2]"
96 . 1 39 ALA N 1 39 ALA CA 1 39 ALA C 1 40 PHE N -62.18 -22.18 -62.48 -61.36 -62.60 2.31 16 0 "[ . 1 . 2]"
97 . 1 40 PHE N 1 40 PHE CA 1 40 PHE C 1 41 LEU N -61.98 -21.98 -50.41 -49.16 -49.60 . . 0 "[ . 1 . 2]"
98 . 1 41 LEU N 1 41 LEU CA 1 41 LEU C 1 42 ARG N -66.07 -26.07 -48.07 -45.93 -46.98 . . 0 "[ . 1 . 2]"
99 . 1 42 ARG N 1 42 ARG CA 1 42 ARG C 1 43 THR N -63.00 -23.00 -40.23 -47.03 -32.76 . . 0 "[ . 1 . 2]"
100 . 1 43 THR N 1 43 THR CA 1 43 THR C 1 44 GLU N -71.49 8.51 -58.10 -15.46 -60.59 . . 0 "[ . 1 . 2]"
101 . 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 TYR N -35.44 24.56 8.57 -4.33 26.29 1.73 16 0 "[ . 1 . 2]"
102 . 1 47 GLU N 1 47 GLU CA 1 47 GLU C 1 48 GLU N -58.42 -18.42 -37.55 -37.78 -39.61 0.03 14 0 "[ . 1 . 2]"
103 . 1 48 GLU N 1 48 GLU CA 1 48 GLU C 1 49 ASN N -62.73 -22.73 -38.70 -33.37 -37.75 0.17 4 0 "[ . 1 . 2]"
104 . 1 49 ASN N 1 49 ASN CA 1 49 ASN C 1 50 MET N -58.19 -18.19 -40.39 -45.85 -33.80 . . 0 "[ . 1 . 2]"
105 . 1 50 MET N 1 50 MET CA 1 50 MET C 1 51 LEU N -58.56 -18.56 -54.86 -60.13 -38.86 1.57 2 0 "[ . 1 . 2]"
106 . 1 51 LEU N 1 51 LEU CA 1 51 LEU C 1 52 PHE N -62.20 -22.20 -45.20 -59.38 -38.44 . . 0 "[ . 1 . 2]"
107 . 1 52 PHE N 1 52 PHE CA 1 52 PHE C 1 53 TRP N -83.42 -3.42 -34.31 -27.68 -28.03 . . 0 "[ . 1 . 2]"
108 . 1 53 TRP N 1 53 TRP CA 1 53 TRP C 1 54 LEU N -64.81 -24.81 -47.10 -46.22 -46.62 . . 0 "[ . 1 . 2]"
109 . 1 54 LEU N 1 54 LEU CA 1 54 LEU C 1 55 ALA N -57.81 -17.81 -44.28 -47.40 -48.98 . . 0 "[ . 1 . 2]"
110 . 1 55 ALA N 1 55 ALA CA 1 55 ALA C 1 56 CYS N -63.47 -23.47 -41.05 -59.51 -35.34 . . 0 "[ . 1 . 2]"
111 . 1 56 CYS N 1 56 CYS CA 1 56 CYS C 1 57 GLU N -62.75 -22.75 -40.90 -40.33 -40.89 . . 0 "[ . 1 . 2]"
112 . 1 57 GLU N 1 57 GLU CA 1 57 GLU C 1 58 GLU N -80.72 -0.72 -21.94 -35.88 -0.62 0.10 1 0 "[ . 1 . 2]"
113 . 1 58 GLU N 1 58 GLU CA 1 58 GLU C 1 59 LEU N -63.30 -23.30 -41.57 -49.66 -28.20 . . 0 "[ . 1 . 2]"
114 . 1 59 LEU N 1 59 LEU CA 1 59 LEU C 1 60 LYS N -80.58 -0.58 -12.61 -10.68 -10.98 . . 0 "[ . 1 . 2]"
115 . 1 60 LYS N 1 60 LYS CA 1 60 LYS C 1 61 ALA N -48.38 -8.38 -24.25 -28.00 -15.82 . . 0 "[ . 1 . 2]"
116 . 1 93 ARG N 1 93 ARG CA 1 93 ARG C 1 94 VAL N -61.91 -21.91 -29.51 -21.43 -23.40 1.96 14 0 "[ . 1 . 2]"
117 . 1 94 VAL N 1 94 VAL CA 1 94 VAL C 1 95 ARG N -61.87 -21.87 -34.56 -43.65 -26.09 . . 0 "[ . 1 . 2]"
118 . 1 95 ARG N 1 95 ARG CA 1 95 ARG C 1 96 GLU N -58.90 -18.90 -30.95 -36.33 -21.27 . . 0 "[ . 1 . 2]"
119 . 1 96 GLU N 1 96 GLU CA 1 96 GLU C 1 97 GLY N -61.04 -21.04 -39.29 -38.71 -41.89 1.67 16 0 "[ . 1 . 2]"
120 . 1 97 GLY N 1 97 GLY CA 1 97 GLY C 1 98 ILE N -61.96 -21.96 -41.00 -45.83 -34.41 . . 0 "[ . 1 . 2]"
121 . 1 98 ILE N 1 98 ILE CA 1 98 ILE C 1 99 ASN N -84.92 -4.92 -32.79 -40.88 -16.98 . . 0 "[ . 1 . 2]"
122 . 1 99 ASN N 1 99 ASN CA 1 99 ASN C 1 100 LYS N -80.34 -0.34 -25.66 -28.04 -29.80 . . 0 "[ . 1 . 2]"
123 . 1 100 LYS N 1 100 LYS CA 1 100 LYS C 1 101 LYS N -55.50 -15.50 -32.97 -52.00 -25.71 . . 0 "[ . 1 . 2]"
124 . 1 101 LYS N 1 101 LYS CA 1 101 LYS C 1 102 MET N -86.16 13.84 -23.23 -33.32 -7.71 . . 0 "[ . 1 . 2]"
125 . 1 112 ASP N 1 112 ASP CA 1 112 ASP C 1 113 ALA N -59.78 -19.78 -45.01 -52.41 -35.06 . . 0 "[ . 1 . 2]"
126 . 1 113 ALA N 1 113 ALA CA 1 113 ALA C 1 114 GLN N -61.40 -21.40 -51.69 -50.56 -51.25 . . 0 "[ . 1 . 2]"
127 . 1 114 GLN N 1 114 GLN CA 1 114 GLN C 1 115 LEU N -61.69 -21.69 -24.80 -27.10 -33.31 0.41 11 0 "[ . 1 . 2]"
128 . 1 115 LEU N 1 115 LEU CA 1 115 LEU C 1 116 GLN N -61.92 -21.92 -55.45 -56.53 -57.12 . . 0 "[ . 1 . 2]"
129 . 1 116 GLN N 1 116 GLN CA 1 116 GLN C 1 117 ILE N -60.33 -20.33 -43.10 -40.93 -41.63 . . 0 "[ . 1 . 2]"
130 . 1 117 ILE N 1 117 ILE CA 1 117 ILE C 1 118 TYR N -58.91 -18.91 -50.14 -47.73 -49.73 . . 0 "[ . 1 . 2]"
131 . 1 118 TYR N 1 118 TYR CA 1 118 TYR C 1 119 THR N -61.80 -21.80 -26.10 -24.50 -24.94 . . 0 "[ . 1 . 2]"
132 . 1 119 THR N 1 119 THR CA 1 119 THR C 1 120 LEU N -63.14 -23.14 -35.13 -34.23 -34.67 . . 0 "[ . 1 . 2]"
133 . 1 120 LEU N 1 120 LEU CA 1 120 LEU C 1 121 MET N -64.91 -24.91 -47.25 -42.63 -44.80 . . 0 "[ . 1 . 2]"
134 . 1 121 MET N 1 121 MET CA 1 121 MET C 1 122 HIS N -57.80 -17.80 -43.54 -58.91 -23.55 1.11 14 0 "[ . 1 . 2]"
135 . 1 122 HIS N 1 122 HIS CA 1 122 HIS C 1 123 ARG N -61.96 -21.96 -34.38 -37.48 -31.70 . . 0 "[ . 1 . 2]"
136 . 1 123 ARG N 1 123 ARG CA 1 123 ARG C 1 124 ASP N -68.85 11.15 -41.07 -49.64 -30.03 . . 0 "[ . 1 . 2]"
137 . 1 125 SER N 1 125 SER CA 1 125 SER C 1 126 TYR N -84.18 -4.18 -30.45 -38.15 -20.47 . . 0 "[ . 1 . 2]"
138 . 1 126 TYR N 1 126 TYR CA 1 126 TYR C 1 127 PRO N -79.42 0.58 -44.57 -41.73 -41.78 . . 0 "[ . 1 . 2]"
139 . 1 127 PRO N 1 127 PRO CA 1 127 PRO C 1 128 ARG N -64.31 -24.31 -37.92 -35.84 -35.97 . . 0 "[ . 1 . 2]"
140 . 1 128 ARG N 1 128 ARG CA 1 128 ARG C 1 129 PHE N -61.15 -21.15 -37.08 -41.60 -31.25 . . 0 "[ . 1 . 2]"
141 . 1 129 PHE N 1 129 PHE CA 1 129 PHE C 1 130 LEU N -79.88 0.12 -50.00 -37.34 -37.90 . . 0 "[ . 1 . 2]"
142 . 1 130 LEU N 1 130 LEU CA 1 130 LEU C 1 131 SER N -71.89 8.11 -10.50 -14.01 -6.86 . . 0 "[ . 1 . 2]"
143 . 1 134 THR N 1 134 THR CA 1 134 THR C 1 135 TYR N -62.63 -22.63 -28.95 -32.15 -23.63 . . 0 "[ . 1 . 2]"
144 . 1 135 TYR N 1 135 TYR CA 1 135 TYR C 1 136 ARG N -62.09 -22.09 -30.98 -29.61 -30.25 . . 0 "[ . 1 . 2]"
145 . 1 136 ARG N 1 136 ARG CA 1 136 ARG C 1 137 ALA N -86.99 13.01 8.94 -2.08 -12.19 1.10 9 0 "[ . 1 . 2]"
146 . 1 137 ALA N 1 137 ALA CA 1 137 ALA C 1 138 LEU N -56.07 -16.07 -29.38 -31.80 -23.97 . . 0 "[ . 1 . 2]"
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