NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
615692 |
2ncn   |
26603 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2ncn
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 214
_TA_constraint_stats_list.Viol_count 331
_TA_constraint_stats_list.Viol_total 2782.29
_TA_constraint_stats_list.Viol_max 3.75
_TA_constraint_stats_list.Viol_rms 0.41
_TA_constraint_stats_list.Viol_average_all_restraints 0.13
_TA_constraint_stats_list.Viol_average_violations_only 0.84
_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 20 SER C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -92.39 -32.39 -58.67 -66.07 -53.58 . . 0 "[ . 1]"
2 . 1 20 SER C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -70.90 -43.94 -58.67 -66.07 -53.58 . . 0 "[ . 1]"
3 . 1 22 ALA C 1 23 ILE N 1 23 ILE CA 1 23 ILE C -92.42 -32.42 -66.02 -70.14 -59.89 . . 0 "[ . 1]"
4 . 1 22 ALA C 1 23 ILE N 1 23 ILE CA 1 23 ILE C -77.57 -59.23 -66.02 -70.14 -59.89 . . 0 "[ . 1]"
5 . 1 26 GLU C 1 27 GLU N 1 27 GLU CA 1 27 GLU C -90.33 -30.33 -60.61 -58.17 -59.80 . . 0 "[ . 1]"
6 . 1 26 GLU C 1 27 GLU N 1 27 GLU CA 1 27 GLU C -76.27 -58.27 -60.61 -58.17 -59.80 1.42 2 0 "[ . 1]"
7 . 1 27 GLU C 1 28 VAL N 1 28 VAL CA 1 28 VAL C -89.93 -29.93 -63.38 -67.50 -59.14 . . 0 "[ . 1]"
8 . 1 27 GLU C 1 28 VAL N 1 28 VAL CA 1 28 VAL C -72.56 -57.04 -63.38 -67.50 -59.14 . . 0 "[ . 1]"
9 . 1 30 GLY C 1 31 ILE N 1 31 ILE CA 1 31 ILE C -97.43 -37.43 -60.46 -63.07 -58.25 . . 0 "[ . 1]"
10 . 1 30 GLY C 1 31 ILE N 1 31 ILE CA 1 31 ILE C -77.72 -54.92 -60.46 -63.07 -58.25 . . 0 "[ . 1]"
11 . 1 31 ILE C 1 32 ARG N 1 32 ARG CA 1 32 ARG C -88.30 -28.30 -67.00 -70.64 -60.13 . . 0 "[ . 1]"
12 . 1 31 ILE C 1 32 ARG N 1 32 ARG CA 1 32 ARG C -70.47 -58.91 -67.00 -70.64 -60.13 0.17 4 0 "[ . 1]"
13 . 1 33 ALA C 1 34 LYS N 1 34 LYS CA 1 34 LYS C -123.70 -63.70 -84.06 -94.05 -75.35 . . 0 "[ . 1]"
14 . 1 33 ALA C 1 34 LYS N 1 34 LYS CA 1 34 LYS C -93.51 -68.77 -84.06 -94.05 -75.35 0.54 10 0 "[ . 1]"
15 . 1 48 ARG C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -103.88 -43.88 -84.30 -69.53 -75.82 . . 0 "[ . 1]"
16 . 1 48 ARG C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -87.85 -49.11 -84.30 -69.53 -75.82 1.29 9 0 "[ . 1]"
17 . 1 56 ASP C 1 57 LYS N 1 57 LYS CA 1 57 LYS C -177.51 -117.51 -129.78 -141.34 -117.29 0.22 1 0 "[ . 1]"
18 . 1 56 ASP C 1 57 LYS N 1 57 LYS CA 1 57 LYS C 177.97 -96.59 -129.78 -141.34 -117.29 . . 0 "[ . 1]"
19 . 1 57 LYS C 1 58 THR N 1 58 THR CA 1 58 THR C -148.19 -88.19 -101.30 -125.05 -87.13 1.06 10 0 "[ . 1]"
20 . 1 68 MET C 1 69 THR N 1 69 THR CA 1 69 THR C -80.11 -20.11 -62.57 -67.62 -54.26 . . 0 "[ . 1]"
21 . 1 68 MET C 1 69 THR N 1 69 THR CA 1 69 THR C -74.79 -54.41 -62.57 -67.62 -54.26 0.15 9 0 "[ . 1]"
22 . 1 70 GLN C 1 71 PHE N 1 71 PHE CA 1 71 PHE C -89.64 -29.64 -69.66 -68.89 -69.30 . . 0 "[ . 1]"
23 . 1 70 GLN C 1 71 PHE N 1 71 PHE CA 1 71 PHE C -68.59 -59.13 -69.66 -68.89 -69.30 1.71 5 0 "[ . 1]"
24 . 1 71 PHE C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -84.80 -24.80 -55.96 -54.37 -54.55 . . 0 "[ . 1]"
25 . 1 71 PHE C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -68.02 -53.32 -55.96 -54.37 -54.55 . . 0 "[ . 1]"
26 . 1 72 LEU C 1 73 SER N 1 73 SER CA 1 73 SER C -86.65 -26.65 -63.98 -67.83 -58.23 . . 0 "[ . 1]"
27 . 1 72 LEU C 1 73 SER N 1 73 SER CA 1 73 SER C -70.93 -55.87 -63.98 -67.83 -58.23 . . 0 "[ . 1]"
28 . 1 73 SER C 1 74 ILE N 1 74 ILE CA 1 74 ILE C -94.95 -34.95 -63.86 -66.39 -58.54 . . 0 "[ . 1]"
29 . 1 73 SER C 1 74 ILE N 1 74 ILE CA 1 74 ILE C -71.74 -56.74 -63.86 -66.39 -58.54 . . 0 "[ . 1]"
30 . 1 74 ILE C 1 75 ILE N 1 75 ILE CA 1 75 ILE C -90.34 -30.34 -57.82 -59.13 -59.65 . . 0 "[ . 1]"
31 . 1 74 ILE C 1 75 ILE N 1 75 ILE CA 1 75 ILE C -71.79 -55.57 -57.82 -59.13 -59.65 0.80 6 0 "[ . 1]"
32 . 1 87 PHE C 1 88 TYR N 1 88 TYR CA 1 88 TYR C -135.69 -75.69 -104.88 -100.65 -101.37 . . 0 "[ . 1]"
33 . 1 87 PHE C 1 88 TYR N 1 88 TYR CA 1 88 TYR C -139.98 -96.24 -104.88 -100.65 -101.37 . . 0 "[ . 1]"
34 . 1 88 TYR C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -131.98 -71.98 -110.72 -121.60 -100.01 . . 0 "[ . 1]"
35 . 1 88 TYR C 1 89 LEU N 1 89 LEU CA 1 89 LEU C -131.41 -97.29 -110.72 -121.60 -100.01 . . 0 "[ . 1]"
36 . 1 99 MET C 1 100 SER N 1 100 SER CA 1 100 SER C -120.42 -60.42 -94.91 -109.05 -85.02 . . 0 "[ . 1]"
37 . 1 99 MET C 1 100 SER N 1 100 SER CA 1 100 SER C -112.93 -76.45 -94.91 -109.05 -85.02 . . 0 "[ . 1]"
38 . 1 102 THR C 1 103 MET N 1 103 MET CA 1 103 MET C -87.94 -27.94 -59.19 -55.16 -55.97 . . 0 "[ . 1]"
39 . 1 102 THR C 1 103 MET N 1 103 MET CA 1 103 MET C -72.80 -54.00 -59.19 -55.16 -55.97 . . 0 "[ . 1]"
40 . 1 103 MET C 1 104 ALA N 1 104 ALA CA 1 104 ALA C -73.31 -13.31 -59.02 -56.68 -56.89 . . 0 "[ . 1]"
41 . 1 103 MET C 1 104 ALA N 1 104 ALA CA 1 104 ALA C -74.26 -52.90 -59.02 -56.68 -56.89 . . 0 "[ . 1]"
42 . 1 104 ALA C 1 105 GLU N 1 105 GLU CA 1 105 GLU C -102.77 -42.77 -63.71 -67.00 -59.90 . . 0 "[ . 1]"
43 . 1 104 ALA C 1 105 GLU N 1 105 GLU CA 1 105 GLU C -72.59 -60.07 -63.71 -67.00 -59.90 0.17 10 0 "[ . 1]"
44 . 1 106 ILE C 1 107 TYR N 1 107 TYR CA 1 107 TYR C -84.95 -24.95 -61.79 -62.82 -63.16 . . 0 "[ . 1]"
45 . 1 106 ILE C 1 107 TYR N 1 107 TYR CA 1 107 TYR C -69.17 -54.23 -61.79 -62.82 -63.16 . . 0 "[ . 1]"
46 . 1 107 TYR C 1 108 ARG N 1 108 ARG CA 1 108 ARG C -86.51 -26.51 -58.82 -59.71 -62.85 . . 0 "[ . 1]"
47 . 1 107 TYR C 1 108 ARG N 1 108 ARG CA 1 108 ARG C -72.60 -57.02 -58.82 -59.71 -62.85 1.24 3 0 "[ . 1]"
48 . 1 109 ASP C 1 110 TYR N 1 110 TYR CA 1 110 TYR C -129.95 -69.95 -102.71 -101.96 -108.89 . . 0 "[ . 1]"
49 . 1 109 ASP C 1 110 TYR N 1 110 TYR CA 1 110 TYR C -133.68 -90.38 -102.71 -101.96 -108.89 . . 0 "[ . 1]"
50 . 1 112 ASP C 1 113 GLU N 1 113 GLU CA 1 113 GLU C -79.78 -19.78 -63.72 -66.20 -68.59 . . 0 "[ . 1]"
51 . 1 112 ASP C 1 113 GLU N 1 113 GLU CA 1 113 GLU C -71.75 -50.55 -63.72 -66.20 -68.59 . . 0 "[ . 1]"
52 . 1 116 PHE C 1 117 VAL N 1 117 VAL CA 1 117 VAL C -130.28 -70.28 -101.48 -103.33 -105.99 . . 0 "[ . 1]"
53 . 1 116 PHE C 1 117 VAL N 1 117 VAL CA 1 117 VAL C -141.71 -95.11 -101.48 -103.33 -105.99 0.71 9 0 "[ . 1]"
54 . 1 118 TYR C 1 119 MET N 1 119 MET CA 1 119 MET C -179.22 -119.22 -121.43 -123.01 -126.14 0.79 2 0 "[ . 1]"
55 . 1 118 TYR C 1 119 MET N 1 119 MET CA 1 119 MET C -151.73 -109.87 -121.43 -123.01 -126.14 . . 0 "[ . 1]"
56 . 1 121 TYR C 1 122 ALA N 1 122 ALA CA 1 122 ALA C -178.72 -118.72 -146.83 -152.87 -152.93 . . 0 "[ . 1]"
57 . 1 121 TYR C 1 122 ALA N 1 122 ALA CA 1 122 ALA C -170.60 -128.56 -146.83 -152.87 -152.93 . . 0 "[ . 1]"
58 . 1 105 GLU C 1 106 ILE N 1 106 ILE CA 1 106 ILE C -91.43 -31.43 -58.85 -61.02 -57.34 . . 0 "[ . 1]"
59 . 1 105 GLU C 1 106 ILE N 1 106 ILE CA 1 106 ILE C -76.89 -57.61 -58.85 -61.02 -57.34 0.27 1 0 "[ . 1]"
60 . 1 100 SER C 1 101 ALA N 1 101 ALA CA 1 101 ALA C -90.66 -30.66 -81.11 -78.35 -81.64 . . 0 "[ . 1]"
61 . 1 100 SER C 1 101 ALA N 1 101 ALA CA 1 101 ALA C -84.98 -51.40 -81.11 -78.35 -81.64 0.60 10 0 "[ . 1]"
62 . 1 98 SER C 1 99 MET N 1 99 MET CA 1 99 MET C -92.49 -32.49 -73.42 -93.17 -60.54 0.68 8 0 "[ . 1]"
63 . 1 98 SER C 1 99 MET N 1 99 MET CA 1 99 MET C -90.61 -51.89 -73.42 -93.17 -60.54 2.56 8 0 "[ . 1]"
64 . 1 3 MET N 1 3 MET CA 1 3 MET C 1 4 PRO N 104.69 167.73 124.22 118.15 115.01 . . 0 "[ . 1]"
65 . 1 2 SER C 1 3 MET N 1 3 MET CA 1 3 MET C -96.17 -49.59 -86.41 -90.54 -94.42 1.00 1 0 "[ . 1]"
66 . 1 4 PRO N 1 4 PRO CA 1 4 PRO C 1 5 PRO N 130.11 169.21 132.48 128.14 137.40 1.97 8 0 "[ . 1]"
67 . 1 3 MET C 1 4 PRO N 1 4 PRO CA 1 4 PRO C -76.58 -54.42 -65.11 -65.85 -70.22 0.21 8 0 "[ . 1]"
68 . 1 5 PRO N 1 5 PRO CA 1 5 PRO C 1 6 PRO N 121.12 173.10 127.76 121.68 121.04 2.05 9 0 "[ . 1]"
69 . 1 4 PRO C 1 5 PRO N 1 5 PRO CA 1 5 PRO C -79.50 -45.74 -64.55 -60.09 -62.41 . . 0 "[ . 1]"
70 . 1 19 LYS N 1 19 LYS CA 1 19 LYS C 1 20 SER N 124.78 174.36 131.49 123.14 121.03 3.75 1 0 "[ . 1]"
71 . 1 18 ARG C 1 19 LYS N 1 19 LYS CA 1 19 LYS C -157.20 -99.46 -121.91 -157.53 -98.16 1.30 6 0 "[ . 1]"
72 . 1 20 SER N 1 20 SER CA 1 20 SER C 1 21 LEU N 104.48 -175.02 173.20 177.09 169.48 0.45 9 0 "[ . 1]"
73 . 1 19 LYS C 1 20 SER N 1 20 SER CA 1 20 SER C -91.72 -47.72 -81.01 -81.65 -87.18 2.66 10 0 "[ . 1]"
74 . 1 21 LEU N 1 21 LEU CA 1 21 LEU C 1 22 ALA N -52.02 -27.88 -47.42 -48.14 -48.59 . . 0 "[ . 1]"
75 . 1 22 ALA N 1 22 ALA CA 1 22 ALA C 1 23 ILE N -52.96 -25.94 -45.94 -45.36 -46.91 . . 0 "[ . 1]"
76 . 1 21 LEU C 1 22 ALA N 1 22 ALA CA 1 22 ALA C -72.31 -54.01 -59.72 -57.06 -58.60 . . 0 "[ . 1]"
77 . 1 23 ILE N 1 23 ILE CA 1 23 ILE C 1 24 ARG N -49.96 -30.12 -31.29 -30.05 -33.01 1.23 4 0 "[ . 1]"
78 . 1 24 ARG N 1 24 ARG CA 1 24 ARG C 1 25 GLN N -53.78 -30.00 -40.82 -36.58 -38.85 . . 0 "[ . 1]"
79 . 1 23 ILE C 1 24 ARG N 1 24 ARG CA 1 24 ARG C -73.86 -54.04 -64.32 -65.11 -65.51 . . 0 "[ . 1]"
80 . 1 25 GLN N 1 25 GLN CA 1 25 GLN C 1 26 GLU N -47.10 -32.00 -35.74 -44.16 -30.42 1.58 10 0 "[ . 1]"
81 . 1 24 ARG C 1 25 GLN N 1 25 GLN CA 1 25 GLN C -68.36 -60.84 -61.56 -60.55 -61.77 1.18 8 0 "[ . 1]"
82 . 1 26 GLU N 1 26 GLU CA 1 26 GLU C 1 27 GLU N -51.62 -29.44 -42.22 -49.71 -52.05 0.66 7 0 "[ . 1]"
83 . 1 25 GLN C 1 26 GLU N 1 26 GLU CA 1 26 GLU C -73.48 -59.68 -73.48 -73.84 -74.06 3.37 7 0 "[ . 1]"
84 . 1 27 GLU N 1 27 GLU CA 1 27 GLU C 1 28 VAL N -46.14 -37.14 -48.21 -49.38 -45.07 3.24 3 0 "[ . 1]"
85 . 1 28 VAL N 1 28 VAL CA 1 28 VAL C 1 29 ALA N -49.73 -33.59 -38.89 -37.41 -37.43 . . 0 "[ . 1]"
86 . 1 29 ALA N 1 29 ALA CA 1 29 ALA C 1 30 GLY N -46.23 -30.77 -46.52 -47.71 -45.56 1.48 5 0 "[ . 1]"
87 . 1 28 VAL C 1 29 ALA N 1 29 ALA CA 1 29 ALA C -70.95 -56.15 -59.10 -59.62 -60.61 0.82 9 0 "[ . 1]"
88 . 1 30 GLY N 1 30 GLY CA 1 30 GLY C 1 31 ILE N -52.58 -31.68 -45.79 -42.84 -45.65 . . 0 "[ . 1]"
89 . 1 29 ALA C 1 30 GLY N 1 30 GLY CA 1 30 GLY C -73.41 -57.67 -66.81 -69.46 -63.14 . . 0 "[ . 1]"
90 . 1 31 ILE N 1 31 ILE CA 1 31 ILE C 1 32 ARG N -53.73 -33.33 -48.90 -51.46 -44.67 . . 0 "[ . 1]"
91 . 1 32 ARG N 1 32 ARG CA 1 32 ARG C 1 33 ALA N -40.10 -24.92 -28.88 -32.99 -39.21 0.37 2 0 "[ . 1]"
92 . 1 33 ALA N 1 33 ALA CA 1 33 ALA C 1 34 LYS N -43.80 -23.70 -36.85 -39.12 -40.76 0.35 3 0 "[ . 1]"
93 . 1 32 ARG C 1 33 ALA N 1 33 ALA CA 1 33 ALA C -80.27 -60.15 -77.48 -76.47 -77.90 0.36 3 0 "[ . 1]"
94 . 1 34 LYS N 1 34 LYS CA 1 34 LYS C 1 35 PHE N -41.39 -21.79 -36.57 -42.28 -27.18 0.89 10 0 "[ . 1]"
95 . 1 35 PHE N 1 35 PHE CA 1 35 PHE C 1 36 PRO N 56.72 86.16 82.82 85.17 83.12 0.65 9 0 "[ . 1]"
96 . 1 34 LYS C 1 35 PHE N 1 35 PHE CA 1 35 PHE C -142.69 -118.55 -128.68 -122.90 -125.61 . . 0 "[ . 1]"
97 . 1 36 PRO N 1 36 PRO CA 1 36 PRO C 1 37 ASN N -34.20 -10.26 -25.13 -29.65 -20.92 . . 0 "[ . 1]"
98 . 1 35 PHE C 1 36 PRO N 1 36 PRO CA 1 36 PRO C -75.76 -51.50 -66.21 -71.48 -62.20 . . 0 "[ . 1]"
99 . 1 37 ASN N 1 37 ASN CA 1 37 ASN C 1 38 LYS N -14.07 22.05 -10.38 -14.93 -5.10 0.86 6 0 "[ . 1]"
100 . 1 36 PRO C 1 37 ASN N 1 37 ASN CA 1 37 ASN C -109.96 -74.64 -89.75 -99.93 -82.32 . . 0 "[ . 1]"
101 . 1 38 LYS N 1 38 LYS CA 1 38 LYS C 1 39 ILE N 114.66 173.86 143.98 113.98 159.20 0.68 2 0 "[ . 1]"
102 . 1 37 ASN C 1 38 LYS N 1 38 LYS CA 1 38 LYS C -143.92 -85.82 -105.98 -103.89 -107.46 . . 0 "[ . 1]"
103 . 1 39 ILE N 1 39 ILE CA 1 39 ILE C 1 40 PRO N 94.73 154.45 126.53 126.70 126.43 . . 0 "[ . 1]"
104 . 1 38 LYS C 1 39 ILE N 1 39 ILE CA 1 39 ILE C -145.73 -88.51 -116.22 -105.97 -116.68 . . 0 "[ . 1]"
105 . 1 40 PRO N 1 40 PRO CA 1 40 PRO C 1 41 VAL N 103.58 -178.42 107.26 102.19 115.13 1.39 6 0 "[ . 1]"
106 . 1 39 ILE C 1 40 PRO N 1 40 PRO CA 1 40 PRO C -87.49 -61.29 -77.92 -78.41 -80.05 . . 0 "[ . 1]"
107 . 1 41 VAL N 1 41 VAL CA 1 41 VAL C 1 42 VAL N 115.30 149.90 140.81 132.42 150.34 0.44 3 0 "[ . 1]"
108 . 1 40 PRO C 1 41 VAL N 1 41 VAL CA 1 41 VAL C -137.22 -107.76 -110.00 -109.49 -110.26 0.41 5 0 "[ . 1]"
109 . 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 VAL N 108.48 140.54 118.67 118.40 112.99 0.31 6 0 "[ . 1]"
110 . 1 41 VAL C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -126.07 -89.25 -114.86 -124.06 -105.74 . . 0 "[ . 1]"
111 . 1 43 VAL N 1 43 VAL CA 1 43 VAL C 1 44 GLU N 111.28 144.52 120.61 110.50 128.06 0.78 9 0 "[ . 1]"
112 . 1 42 VAL C 1 43 VAL N 1 43 VAL CA 1 43 VAL C -128.08 -97.98 -103.88 -101.79 -102.26 0.40 10 0 "[ . 1]"
113 . 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 ARG N 132.28 168.78 146.75 139.04 162.64 . . 0 "[ . 1]"
114 . 1 43 VAL C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -162.35 -112.21 -119.86 -111.53 -111.62 0.68 2 0 "[ . 1]"
115 . 1 45 ARG N 1 45 ARG CA 1 45 ARG C 1 46 TYR N 117.17 151.13 139.00 121.44 152.24 1.11 4 0 "[ . 1]"
116 . 1 44 GLU C 1 45 ARG N 1 45 ARG CA 1 45 ARG C -96.26 -54.72 -78.81 -74.78 -76.81 . . 0 "[ . 1]"
117 . 1 46 TYR N 1 46 TYR CA 1 46 TYR C 1 47 PRO N 107.30 173.10 128.55 127.78 124.09 . . 0 "[ . 1]"
118 . 1 45 ARG C 1 46 TYR N 1 46 TYR CA 1 46 TYR C -146.08 -17.62 -64.85 -87.89 -51.49 . . 0 "[ . 1]"
119 . 1 47 PRO N 1 47 PRO CA 1 47 PRO C 1 48 ARG N -34.67 -8.51 -20.05 -29.59 -7.73 0.78 4 0 "[ . 1]"
120 . 1 46 TYR C 1 47 PRO N 1 47 PRO CA 1 47 PRO C -81.80 -52.32 -59.69 -54.54 -56.89 . . 0 "[ . 1]"
121 . 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 THR N 122.80 152.44 140.72 150.20 139.27 2.17 2 0 "[ . 1]"
122 . 1 52 LEU N 1 52 LEU CA 1 52 LEU C 1 53 PRO N 112.75 164.39 123.00 121.68 115.13 1.91 7 0 "[ . 1]"
123 . 1 51 PHE C 1 52 LEU N 1 52 LEU CA 1 52 LEU C -104.71 -42.75 -87.06 -106.99 -58.37 2.28 6 0 "[ . 1]"
124 . 1 53 PRO N 1 53 PRO CA 1 53 PRO C 1 54 PRO N 122.30 162.60 144.46 122.51 164.57 1.97 7 0 "[ . 1]"
125 . 1 52 LEU C 1 53 PRO N 1 53 PRO CA 1 53 PRO C -76.23 -45.37 -66.83 -52.73 -69.12 2.03 7 0 "[ . 1]"
126 . 1 54 PRO N 1 54 PRO CA 1 54 PRO C 1 55 LEU N 122.36 168.86 154.03 157.96 139.90 1.11 9 0 "[ . 1]"
127 . 1 53 PRO C 1 54 PRO N 1 54 PRO CA 1 54 PRO C -83.44 -49.62 -60.04 -70.05 -49.74 . . 0 "[ . 1]"
128 . 1 57 LYS N 1 57 LYS CA 1 57 LYS C 1 58 THR N 124.92 171.40 148.22 160.21 154.65 . . 0 "[ . 1]"
129 . 1 59 LYS N 1 59 LYS CA 1 59 LYS C 1 60 PHE N 112.20 145.38 124.81 111.48 145.60 0.72 10 0 "[ . 1]"
130 . 1 58 THR C 1 59 LYS N 1 59 LYS CA 1 59 LYS C -122.55 -81.53 -110.15 -92.67 -103.21 . . 0 "[ . 1]"
131 . 1 60 PHE N 1 60 PHE CA 1 60 PHE C 1 61 LEU N 117.96 144.64 136.79 125.22 121.31 1.54 10 0 "[ . 1]"
132 . 1 59 LYS C 1 60 PHE N 1 60 PHE CA 1 60 PHE C -138.57 -100.21 -121.32 -119.26 -124.81 . . 0 "[ . 1]"
133 . 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 VAL N 105.07 137.39 108.07 103.41 103.04 2.51 6 0 "[ . 1]"
134 . 1 60 PHE C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -118.70 -81.62 -100.30 -94.79 -95.82 . . 0 "[ . 1]"
135 . 1 62 VAL N 1 62 VAL CA 1 62 VAL C 1 63 PRO N 109.59 161.17 143.59 132.18 156.30 . . 0 "[ . 1]"
136 . 1 61 LEU C 1 62 VAL N 1 62 VAL CA 1 62 VAL C -135.39 -88.69 -118.14 -111.15 -114.32 . . 0 "[ . 1]"
137 . 1 64 GLN N 1 64 GLN CA 1 64 GLN C 1 65 GLU N -37.90 -12.20 -18.25 -33.47 -11.96 0.24 10 0 "[ . 1]"
138 . 1 63 PRO C 1 64 GLN N 1 64 GLN CA 1 64 GLN C -75.25 -49.35 -65.74 -68.10 -70.06 . . 0 "[ . 1]"
139 . 1 65 GLU N 1 65 GLU CA 1 65 GLU C 1 66 LEU N -33.21 11.41 -8.07 11.61 -3.33 0.20 2 0 "[ . 1]"
140 . 1 64 GLN C 1 65 GLU N 1 65 GLU CA 1 65 GLU C -100.33 -63.21 -84.57 -99.95 -78.08 . . 0 "[ . 1]"
141 . 1 66 LEU N 1 66 LEU CA 1 66 LEU C 1 67 THR N 113.24 155.74 132.53 117.06 147.16 . . 0 "[ . 1]"
142 . 1 65 GLU C 1 66 LEU N 1 66 LEU CA 1 66 LEU C -84.47 -54.83 -75.80 -85.00 -70.84 0.53 9 0 "[ . 1]"
143 . 1 67 THR N 1 67 THR CA 1 67 THR C 1 68 MET N 155.79 177.77 162.20 155.60 171.22 0.19 6 0 "[ . 1]"
144 . 1 66 LEU C 1 67 THR N 1 67 THR CA 1 67 THR C -138.20 -79.02 -92.87 -82.43 -89.67 0.19 2 0 "[ . 1]"
145 . 1 68 MET N 1 68 MET CA 1 68 MET C 1 69 THR N -43.80 -25.86 -37.18 -37.97 -41.07 0.59 6 0 "[ . 1]"
146 . 1 67 THR C 1 68 MET N 1 68 MET CA 1 68 MET C -71.37 -55.07 -59.53 -64.28 -55.45 . . 0 "[ . 1]"
147 . 1 69 THR N 1 69 THR CA 1 69 THR C 1 70 GLN N -49.80 -33.08 -44.16 -34.25 -37.09 0.83 10 0 "[ . 1]"
148 . 1 70 GLN N 1 70 GLN CA 1 70 GLN C 1 71 PHE N -48.99 -28.33 -32.84 -38.79 -28.26 0.07 10 0 "[ . 1]"
149 . 1 69 THR C 1 70 GLN N 1 70 GLN CA 1 70 GLN C -74.36 -58.90 -69.65 -73.72 -74.50 0.15 1 0 "[ . 1]"
150 . 1 71 PHE N 1 71 PHE CA 1 71 PHE C 1 72 LEU N -51.36 -33.52 -38.14 -36.97 -37.86 0.00 7 0 "[ . 1]"
151 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 SER N -48.44 -36.64 -43.08 -44.13 -44.42 0.39 9 0 "[ . 1]"
152 . 1 73 SER N 1 73 SER CA 1 73 SER C 1 74 ILE N -48.03 -33.45 -38.76 -34.23 -36.75 1.11 8 0 "[ . 1]"
153 . 1 74 ILE N 1 74 ILE CA 1 74 ILE C 1 75 ILE N -51.58 -35.84 -44.54 -49.28 -40.61 . . 0 "[ . 1]"
154 . 1 75 ILE N 1 75 ILE CA 1 75 ILE C 1 76 ARG N -49.38 -36.02 -44.97 -43.70 -45.25 0.32 10 0 "[ . 1]"
155 . 1 76 ARG N 1 76 ARG CA 1 76 ARG C 1 77 SER N -51.29 -31.15 -33.68 -38.96 -30.55 0.60 4 0 "[ . 1]"
156 . 1 75 ILE C 1 76 ARG N 1 76 ARG CA 1 76 ARG C -68.68 -54.66 -62.92 -54.44 -58.97 0.53 8 0 "[ . 1]"
157 . 1 77 SER N 1 77 SER CA 1 77 SER C 1 78 ARG N -40.65 -14.89 -26.43 -36.39 -16.36 . . 0 "[ . 1]"
158 . 1 76 ARG C 1 77 SER N 1 77 SER CA 1 77 SER C -77.85 -58.25 -76.52 -79.00 -69.63 1.15 8 0 "[ . 1]"
159 . 1 78 ARG N 1 78 ARG CA 1 78 ARG C 1 79 MET N -43.09 2.95 3.42 3.33 3.00 1.05 9 0 "[ . 1]"
160 . 1 77 SER C 1 78 ARG N 1 78 ARG CA 1 78 ARG C -104.90 -65.16 -94.57 -88.14 -89.87 . . 0 "[ . 1]"
161 . 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 ARG N 120.02 163.06 132.89 119.66 162.28 0.35 3 0 "[ . 1]"
162 . 1 80 VAL C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -127.10 -71.40 -113.23 -127.57 -86.87 0.47 4 0 "[ . 1]"
163 . 1 82 ARG N 1 82 ARG CA 1 82 ARG C 1 83 ALA N 121.26 168.82 129.11 121.05 120.19 2.20 8 0 "[ . 1]"
164 . 1 81 LEU C 1 82 ARG N 1 82 ARG CA 1 82 ARG C -90.02 -46.10 -77.63 -71.04 -75.85 0.73 9 0 "[ . 1]"
165 . 1 87 PHE N 1 87 PHE CA 1 87 PHE C 1 88 TYR N 119.87 150.87 150.13 144.24 152.71 1.84 3 0 "[ . 1]"
166 . 1 86 ALA C 1 87 PHE N 1 87 PHE CA 1 87 PHE C -174.22 -113.32 -148.28 -172.94 -125.94 . . 0 "[ . 1]"
167 . 1 88 TYR N 1 88 TYR CA 1 88 TYR C 1 89 LEU N 110.69 161.27 144.79 148.24 139.69 . . 0 "[ . 1]"
168 . 1 89 LEU N 1 89 LEU CA 1 89 LEU C 1 90 LEU N 112.18 145.50 117.38 115.64 113.89 1.00 1 0 "[ . 1]"
169 . 1 90 LEU N 1 90 LEU CA 1 90 LEU C 1 91 VAL N 103.83 148.93 136.26 150.56 145.89 1.63 2 0 "[ . 1]"
170 . 1 89 LEU C 1 90 LEU N 1 90 LEU CA 1 90 LEU C -127.45 -86.55 -104.81 -127.84 -88.85 0.39 6 0 "[ . 1]"
171 . 1 91 VAL N 1 91 VAL CA 1 91 VAL C 1 92 ASN N 112.76 131.48 119.71 110.63 129.48 2.13 10 0 "[ . 1]"
172 . 1 90 LEU C 1 91 VAL N 1 91 VAL CA 1 91 VAL C -138.66 -104.34 -103.54 -101.93 -102.15 2.41 2 0 "[ . 1]"
173 . 1 92 ASN N 1 92 ASN CA 1 92 ASN C 1 93 ASN N 30.68 52.18 31.91 41.71 32.36 1.01 1 0 "[ . 1]"
174 . 1 91 VAL C 1 92 ASN N 1 92 ASN CA 1 92 ASN C 48.90 62.14 56.25 51.58 59.42 . . 0 "[ . 1]"
175 . 1 93 ASN N 1 93 ASN CA 1 93 ASN C 1 94 LYS N -2.72 36.16 18.82 -4.12 32.10 1.40 3 0 "[ . 1]"
176 . 1 92 ASN C 1 93 ASN N 1 93 ASN CA 1 93 ASN C 51.65 89.61 59.93 65.01 61.21 0.33 5 0 "[ . 1]"
177 . 1 98 SER N 1 98 SER CA 1 98 SER C 1 99 MET N 90.13 165.27 100.98 116.87 99.57 2.87 9 0 "[ . 1]"
178 . 1 97 VAL C 1 98 SER N 1 98 SER CA 1 98 SER C -121.76 -40.10 -84.58 -118.11 -58.82 . . 0 "[ . 1]"
179 . 1 99 MET N 1 99 MET CA 1 99 MET C 1 100 SER N -32.25 4.61 -21.55 -15.40 -19.10 0.95 8 0 "[ . 1]"
180 . 1 100 SER N 1 100 SER CA 1 100 SER C 1 101 ALA N -18.77 16.39 -6.77 -17.17 7.59 . . 0 "[ . 1]"
181 . 1 101 ALA N 1 101 ALA CA 1 101 ALA C 1 102 THR N 124.91 161.53 140.34 141.05 138.63 . . 0 "[ . 1]"
182 . 1 102 THR N 1 102 THR CA 1 102 THR C 1 103 MET N 151.65 179.51 157.57 160.56 158.49 0.47 4 0 "[ . 1]"
183 . 1 101 ALA C 1 102 THR N 1 102 THR CA 1 102 THR C -135.03 -70.71 -89.99 -90.09 -92.78 . . 0 "[ . 1]"
184 . 1 103 MET N 1 103 MET CA 1 103 MET C 1 104 ALA N -41.65 -25.21 -30.34 -36.76 -23.75 1.46 7 0 "[ . 1]"
185 . 1 104 ALA N 1 104 ALA CA 1 104 ALA C 1 105 GLU N -51.63 -29.63 -51.54 -51.67 -52.02 0.64 5 0 "[ . 1]"
186 . 1 105 GLU N 1 105 GLU CA 1 105 GLU C 1 106 ILE N -51.12 -28.96 -44.32 -43.30 -44.34 . . 0 "[ . 1]"
187 . 1 106 ILE N 1 106 ILE CA 1 106 ILE C 1 107 TYR N -47.60 -29.36 -47.19 -48.36 -42.59 0.76 10 0 "[ . 1]"
188 . 1 107 TYR N 1 107 TYR CA 1 107 TYR C 1 108 ARG N -54.93 -37.05 -46.87 -51.98 -38.86 . . 0 "[ . 1]"
189 . 1 108 ARG N 1 108 ARG CA 1 108 ARG C 1 109 ASP N -48.94 -25.82 -33.89 -45.57 -25.32 0.50 1 0 "[ . 1]"
190 . 1 109 ASP N 1 109 ASP CA 1 109 ASP C 1 110 TYR N -50.40 -11.24 -47.34 -51.32 -36.73 0.92 2 0 "[ . 1]"
191 . 1 108 ARG C 1 109 ASP N 1 109 ASP CA 1 109 ASP C -102.26 -58.44 -95.76 -90.17 -92.67 0.72 9 0 "[ . 1]"
192 . 1 110 TYR N 1 110 TYR CA 1 110 TYR C 1 111 LYS N -26.50 27.06 17.12 10.78 21.79 . . 0 "[ . 1]"
193 . 1 111 LYS N 1 111 LYS CA 1 111 LYS C 1 112 ASP N 117.86 156.84 131.75 120.95 141.99 . . 0 "[ . 1]"
194 . 1 110 TYR C 1 111 LYS N 1 111 LYS CA 1 111 LYS C -80.65 -51.51 -61.33 -65.86 -55.25 . . 0 "[ . 1]"
195 . 1 112 ASP N 1 112 ASP CA 1 112 ASP C 1 113 GLU N 134.31 -166.41 -176.77 177.36 -172.03 . . 0 "[ . 1]"
196 . 1 111 LYS C 1 112 ASP N 1 112 ASP CA 1 112 ASP C -119.76 -57.52 -83.26 -80.49 -82.65 . . 0 "[ . 1]"
197 . 1 113 GLU N 1 113 GLU CA 1 113 GLU C 1 114 ASP N -42.47 -11.07 -35.48 -42.60 -23.39 0.13 8 0 "[ . 1]"
198 . 1 114 ASP N 1 114 ASP CA 1 114 ASP C 1 115 GLY N -11.15 10.69 -12.13 -13.27 -10.43 2.12 8 0 "[ . 1]"
199 . 1 113 GLU C 1 114 ASP N 1 114 ASP CA 1 114 ASP C -98.26 -68.36 -81.12 -82.41 -85.56 . . 0 "[ . 1]"
200 . 1 115 GLY N 1 115 GLY CA 1 115 GLY C 1 116 PHE N -22.01 15.11 -10.76 2.78 -5.47 0.65 9 0 "[ . 1]"
201 . 1 114 ASP C 1 115 GLY N 1 115 GLY CA 1 115 GLY C 75.94 108.64 104.54 93.43 109.10 0.46 3 0 "[ . 1]"
202 . 1 116 PHE N 1 116 PHE CA 1 116 PHE C 1 117 VAL N 125.30 163.98 156.46 152.34 162.06 . . 0 "[ . 1]"
203 . 1 115 GLY C 1 116 PHE N 1 116 PHE CA 1 116 PHE C -96.79 -57.97 -85.78 -97.98 -75.35 1.19 2 0 "[ . 1]"
204 . 1 117 VAL N 1 117 VAL CA 1 117 VAL C 1 118 TYR N 110.02 147.38 113.82 108.62 138.73 1.40 7 0 "[ . 1]"
205 . 1 118 TYR N 1 118 TYR CA 1 118 TYR C 1 119 MET N 113.76 154.46 121.52 112.81 129.58 0.95 2 0 "[ . 1]"
206 . 1 117 VAL C 1 118 TYR N 1 118 TYR CA 1 118 TYR C -133.08 -71.78 -97.60 -95.78 -96.54 . . 0 "[ . 1]"
207 . 1 119 MET N 1 119 MET CA 1 119 MET C 1 120 THR N 116.59 164.89 136.03 119.76 155.22 . . 0 "[ . 1]"
208 . 1 120 THR N 1 120 THR CA 1 120 THR C 1 121 TYR N 134.81 171.03 135.22 134.03 133.51 2.33 9 0 "[ . 1]"
209 . 1 119 MET C 1 120 THR N 1 120 THR CA 1 120 THR C -147.71 -102.55 -114.69 -118.95 -123.00 0.79 3 0 "[ . 1]"
210 . 1 121 TYR N 1 121 TYR CA 1 121 TYR C 1 122 ALA N 142.41 164.69 143.91 143.09 142.24 1.44 5 0 "[ . 1]"
211 . 1 120 THR C 1 121 TYR N 1 121 TYR CA 1 121 TYR C -154.30 -118.78 -123.29 -133.37 -117.03 1.75 5 0 "[ . 1]"
212 . 1 122 ALA N 1 122 ALA CA 1 122 ALA C 1 123 SER N 137.29 -179.43 157.57 141.84 174.47 . . 0 "[ . 1]"
213 . 1 124 GLN N 1 124 GLN CA 1 124 GLN C 1 125 GLU N 132.50 -175.28 141.81 130.24 -175.88 2.26 2 0 "[ . 1]"
214 . 1 123 SER C 1 124 GLN N 1 124 GLN CA 1 124 GLN C -173.68 -92.14 -134.81 -157.46 -90.22 1.92 9 0 "[ . 1]"
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