NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
557277 |
2m47   |
18989 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2m47
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 564
_TA_constraint_stats_list.Viol_total 19541.14
_TA_constraint_stats_list.Viol_max 8.12
_TA_constraint_stats_list.Viol_rms 0.76
_TA_constraint_stats_list.Viol_average_all_restraints 0.23
_TA_constraint_stats_list.Viol_average_violations_only 1.73
_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 5 LEU C 1 6 THR N 1 6 THR CA 1 6 THR C -175.60 -94.60 -134.01 -163.06 -94.86 . . 0 "[ . 1 . 2]"
2 . 1 6 THR N 1 6 THR CA 1 6 THR C 1 7 PHE N 134.40 -179.00 138.76 144.69 140.53 2.36 5 0 "[ . 1 . 2]"
3 . 1 6 THR C 1 7 PHE N 1 7 PHE CA 1 7 PHE C -161.30 -121.10 -149.73 -161.73 -137.41 0.43 5 0 "[ . 1 . 2]"
4 . 1 7 PHE N 1 7 PHE CA 1 7 PHE C 1 8 GLU N 106.20 -177.80 148.39 134.40 154.04 . . 0 "[ . 1 . 2]"
5 . 1 7 PHE C 1 8 GLU N 1 8 GLU CA 1 8 GLU C -154.10 -104.30 -141.09 -137.38 -138.59 0.94 10 0 "[ . 1 . 2]"
6 . 1 8 GLU N 1 8 GLU CA 1 8 GLU C 1 9 ASP N 128.80 173.80 156.25 157.61 155.45 . . 0 "[ . 1 . 2]"
7 . 1 8 GLU C 1 9 ASP N 1 9 ASP CA 1 9 ASP C 175.90 -97.10 -154.62 -166.85 -142.00 . . 0 "[ . 1 . 2]"
8 . 1 9 ASP N 1 9 ASP CA 1 9 ASP C 1 10 SER N 118.10 -179.90 152.59 154.48 151.95 . . 0 "[ . 1 . 2]"
9 . 1 9 ASP C 1 10 SER N 1 10 SER CA 1 10 SER C -171.90 -111.70 -142.60 -155.66 -114.71 . . 0 "[ . 1 . 2]"
10 . 1 10 SER N 1 10 SER CA 1 10 SER C 1 11 ILE N 131.90 173.30 146.02 150.25 146.96 1.80 20 0 "[ . 1 . 2]"
11 . 1 10 SER C 1 11 ILE N 1 11 ILE CA 1 11 ILE C -160.80 -119.00 -150.34 -160.91 -133.17 0.11 10 0 "[ . 1 . 2]"
12 . 1 11 ILE N 1 11 ILE CA 1 11 ILE C 1 12 ASN N 116.30 160.10 139.26 131.01 149.80 . . 0 "[ . 1 . 2]"
13 . 1 11 ILE C 1 12 ASN N 1 12 ASN CA 1 12 ASN C -145.40 -79.40 -86.36 -88.25 -89.06 0.87 16 0 "[ . 1 . 2]"
14 . 1 12 ASN N 1 12 ASN CA 1 12 ASN C 1 13 ILE N 101.90 147.70 115.84 98.46 138.24 3.44 2 0 "[ . 1 . 2]"
15 . 1 12 ASN C 1 13 ILE N 1 13 ILE CA 1 13 ILE C 178.80 -41.20 -96.65 -90.64 -95.26 . . 0 "[ . 1 . 2]"
16 . 1 13 ILE N 1 13 ILE CA 1 13 ILE C 1 14 ALA N 119.80 -138.40 136.03 119.01 151.94 0.79 10 0 "[ . 1 . 2]"
17 . 1 16 PRO C 1 17 ILE N 1 17 ILE CA 1 17 ILE C -68.20 -28.20 -58.53 -61.62 -64.34 1.16 12 0 "[ . 1 . 2]"
18 . 1 17 ILE N 1 17 ILE CA 1 17 ILE C 1 18 ASN N -67.60 -27.60 -30.43 -39.38 -24.80 2.80 14 0 "[ . 1 . 2]"
19 . 1 17 ILE C 1 18 ASN N 1 18 ASN CA 1 18 ASN C -84.00 -44.00 -60.16 -69.56 -50.51 . . 0 "[ . 1 . 2]"
20 . 1 18 ASN N 1 18 ASN CA 1 18 ASN C 1 19 GLN N -61.70 -21.70 -44.49 -39.57 -42.31 . . 0 "[ . 1 . 2]"
21 . 1 18 ASN C 1 19 GLN N 1 19 GLN CA 1 19 GLN C -86.80 -46.80 -72.30 -66.59 -67.39 1.03 14 0 "[ . 1 . 2]"
22 . 1 19 GLN N 1 19 GLN CA 1 19 GLN C 1 20 VAL N -61.90 -21.90 -40.35 -45.83 -49.64 0.03 11 0 "[ . 1 . 2]"
23 . 1 19 GLN C 1 20 VAL N 1 20 VAL CA 1 20 VAL C -81.20 -41.20 -62.01 -62.18 -63.97 . . 0 "[ . 1 . 2]"
24 . 1 20 VAL N 1 20 VAL CA 1 20 VAL C 1 21 TYR N -67.10 -27.10 -45.60 -59.67 -34.36 . . 0 "[ . 1 . 2]"
25 . 1 20 VAL C 1 21 TYR N 1 21 TYR CA 1 21 TYR C -78.10 -38.10 -62.70 -60.00 -62.11 . . 0 "[ . 1 . 2]"
26 . 1 21 TYR N 1 21 TYR CA 1 21 TYR C 1 22 ALA N -61.20 -21.20 -37.66 -41.73 -44.67 . . 0 "[ . 1 . 2]"
27 . 1 21 TYR C 1 22 ALA N 1 22 ALA CA 1 22 ALA C -81.20 -41.20 -67.12 -67.91 -68.48 . . 0 "[ . 1 . 2]"
28 . 1 22 ALA N 1 22 ALA CA 1 22 ALA C 1 23 LEU N -56.80 -16.20 -37.05 -56.23 -20.85 . . 0 "[ . 1 . 2]"
29 . 1 22 ALA C 1 23 LEU N 1 23 LEU CA 1 23 LEU C -91.10 -51.10 -80.37 -74.35 -76.55 0.30 5 0 "[ . 1 . 2]"
30 . 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 VAL N -53.50 -10.50 -25.08 -22.48 -30.63 3.44 3 0 "[ . 1 . 2]"
31 . 1 23 LEU C 1 24 VAL N 1 24 VAL CA 1 24 VAL C -84.20 -44.20 -74.55 -72.56 -73.57 0.33 15 0 "[ . 1 . 2]"
32 . 1 24 VAL N 1 24 VAL CA 1 24 VAL C 1 25 SER N -54.10 -12.10 -38.15 -55.13 -10.77 1.33 4 0 "[ . 1 . 2]"
33 . 1 35 PRO C 1 36 VAL N 1 36 VAL CA 1 36 VAL C -112.90 -72.90 -81.77 -74.76 -77.88 3.22 4 0 "[ . 1 . 2]"
34 . 1 36 VAL N 1 36 VAL CA 1 36 VAL C 1 37 CYS N -38.00 36.00 -13.28 -38.70 27.32 0.70 9 0 "[ . 1 . 2]"
35 . 1 36 VAL C 1 37 CYS N 1 37 CYS CA 1 37 CYS C -155.00 -33.40 -100.99 -93.10 -95.89 1.86 6 0 "[ . 1 . 2]"
36 . 1 37 CYS N 1 37 CYS CA 1 37 CYS C 1 38 GLU N 45.00 -175.00 111.85 75.98 165.70 . . 0 "[ . 1 . 2]"
37 . 1 37 CYS C 1 38 GLU N 1 38 GLU CA 1 38 GLU C -141.30 -53.30 -75.94 -75.59 -78.75 . . 0 "[ . 1 . 2]"
38 . 1 38 GLU N 1 38 GLU CA 1 38 GLU C 1 39 LYS N -55.00 -15.00 -51.96 -51.91 -54.35 5.75 10 1 "[ . + . 2]"
39 . 1 38 GLU C 1 39 LYS N 1 39 LYS CA 1 39 LYS C -172.60 -132.60 -148.68 -172.88 -132.20 0.40 4 0 "[ . 1 . 2]"
40 . 1 39 LYS N 1 39 LYS CA 1 39 LYS C 1 40 CYS N 115.70 162.90 128.53 111.97 148.96 3.73 5 0 "[ . 1 . 2]"
41 . 1 39 LYS C 1 40 CYS N 1 40 CYS CA 1 40 CYS C -145.60 -92.20 -137.71 -125.15 -134.65 3.39 8 0 "[ . 1 . 2]"
42 . 1 40 CYS N 1 40 CYS CA 1 40 CYS C 1 41 TRP N 112.00 155.60 122.03 133.07 130.76 2.29 9 0 "[ . 1 . 2]"
43 . 1 40 CYS C 1 41 TRP N 1 41 TRP CA 1 41 TRP C -156.30 -105.10 -112.37 -109.06 -119.20 4.12 8 0 "[ . 1 . 2]"
44 . 1 41 TRP N 1 41 TRP CA 1 41 TRP C 1 42 TRP N 118.60 174.60 126.56 114.11 159.32 4.49 17 0 "[ . 1 . 2]"
45 . 1 41 TRP C 1 42 TRP N 1 42 TRP CA 1 42 TRP C -121.00 -59.00 -104.35 -85.15 -92.50 3.68 9 0 "[ . 1 . 2]"
46 . 1 42 TRP N 1 42 TRP CA 1 42 TRP C 1 43 ASP N 111.80 -175.60 134.07 110.29 167.90 1.51 15 0 "[ . 1 . 2]"
47 . 1 42 TRP C 1 43 ASP N 1 43 ASP CA 1 43 ASP C -82.40 -42.40 -69.47 -63.65 -64.59 3.39 20 0 "[ . 1 . 2]"
48 . 1 43 ASP N 1 43 ASP CA 1 43 ASP C 1 44 GLU N -49.80 -4.80 -21.34 -42.07 -2.21 2.59 20 0 "[ . 1 . 2]"
49 . 1 43 ASP C 1 44 GLU N 1 44 GLU CA 1 44 GLU C -88.20 -48.20 -61.55 -61.06 -63.06 . . 0 "[ . 1 . 2]"
50 . 1 44 GLU N 1 44 GLU CA 1 44 GLU C 1 45 ASP N -65.70 0.70 -27.11 -45.99 2.83 2.13 19 0 "[ . 1 . 2]"
51 . 1 44 GLU C 1 45 ASP N 1 45 ASP CA 1 45 ASP C -97.60 -47.40 -62.25 -68.24 -71.12 . . 0 "[ . 1 . 2]"
52 . 1 45 ASP N 1 45 ASP CA 1 45 ASP C 1 46 GLU N -56.60 14.60 -36.52 -36.18 -38.93 . . 0 "[ . 1 . 2]"
53 . 1 52 ALA C 1 53 HIS N 1 53 HIS CA 1 53 HIS C -150.60 -69.60 -132.30 -108.66 -128.39 5.83 5 1 "[ + 1 . 2]"
54 . 1 53 HIS N 1 53 HIS CA 1 53 HIS C 1 54 PHE N 124.30 168.90 132.44 121.29 157.33 3.01 4 0 "[ . 1 . 2]"
55 . 1 53 HIS C 1 54 PHE N 1 54 PHE CA 1 54 PHE C 151.00 -69.00 -115.64 -159.16 -78.84 . . 0 "[ . 1 . 2]"
56 . 1 54 PHE N 1 54 PHE CA 1 54 PHE C 1 55 THR N 105.60 169.00 135.02 102.18 169.53 3.42 14 0 "[ . 1 . 2]"
57 . 1 54 PHE C 1 55 THR N 1 55 THR CA 1 55 THR C -176.00 -79.60 -114.23 -107.45 -112.85 0.27 19 0 "[ . 1 . 2]"
58 . 1 55 THR N 1 55 THR CA 1 55 THR C 1 56 GLY N 111.80 -164.40 125.90 106.82 160.94 4.98 6 0 "[ . 1 . 2]"
59 . 1 55 THR C 1 56 GLY N 1 56 GLY CA 1 56 GLY C 151.50 -68.50 -131.72 -138.87 -148.15 . . 0 "[ . 1 . 2]"
60 . 1 56 GLY N 1 56 GLY CA 1 56 GLY C 1 57 ARG N 103.50 -141.70 118.42 104.99 103.32 3.90 3 0 "[ . 1 . 2]"
61 . 1 56 GLY C 1 57 ARG N 1 57 ARG CA 1 57 ARG C -161.40 -77.00 -93.22 -154.19 -74.61 2.39 18 0 "[ . 1 . 2]"
62 . 1 57 ARG N 1 57 ARG CA 1 57 ARG C 1 58 ASN N 104.20 144.20 113.45 101.95 129.31 2.25 8 0 "[ . 1 . 2]"
63 . 1 57 ARG C 1 58 ASN N 1 58 ASN CA 1 58 ASN C -126.50 -86.30 -91.99 -92.97 -95.14 1.91 18 0 "[ . 1 . 2]"
64 . 1 58 ASN N 1 58 ASN CA 1 58 ASN C 1 59 VAL N 114.20 154.20 128.94 143.36 143.30 3.58 18 0 "[ . 1 . 2]"
65 . 1 58 ASN C 1 59 VAL N 1 59 VAL CA 1 59 VAL C -149.60 -96.00 -120.61 -150.05 -97.53 0.45 9 0 "[ . 1 . 2]"
66 . 1 59 VAL N 1 59 VAL CA 1 59 VAL C 1 60 THR N 112.00 176.80 120.61 106.29 138.26 5.71 3 1 "[ + . 1 . 2]"
67 . 1 59 VAL C 1 60 THR N 1 60 THR CA 1 60 THR C -156.80 -39.00 -129.40 -120.02 -130.74 . . 0 "[ . 1 . 2]"
68 . 1 60 THR N 1 60 THR CA 1 60 THR C 1 61 PRO N 93.50 -162.90 156.94 141.35 166.30 . . 0 "[ . 1 . 2]"
69 . 1 62 GLU C 1 63 ARG N 1 63 ARG CA 1 63 ARG C 164.70 -55.30 -141.53 -167.93 -122.31 . . 0 "[ . 1 . 2]"
70 . 1 63 ARG N 1 63 ARG CA 1 63 ARG C 1 64 THR N 110.50 163.30 141.65 116.27 164.80 1.50 1 0 "[ . 1 . 2]"
71 . 1 63 ARG C 1 64 THR N 1 64 THR CA 1 64 THR C -158.00 -83.80 -123.38 -116.80 -127.71 . . 0 "[ . 1 . 2]"
72 . 1 64 THR N 1 64 THR CA 1 64 THR C 1 65 TRP N 107.30 157.10 119.39 117.17 112.15 2.31 6 0 "[ . 1 . 2]"
73 . 1 64 THR C 1 65 TRP N 1 65 TRP CA 1 65 TRP C -172.10 -106.50 -151.01 -171.69 -115.83 . . 0 "[ . 1 . 2]"
74 . 1 65 TRP N 1 65 TRP CA 1 65 TRP C 1 66 GLU N 131.60 177.00 145.19 131.16 163.70 0.44 16 0 "[ . 1 . 2]"
75 . 1 65 TRP C 1 66 GLU N 1 66 GLU CA 1 66 GLU C -137.50 -85.10 -101.97 -110.72 -117.20 2.46 20 0 "[ . 1 . 2]"
76 . 1 66 GLU N 1 66 GLU CA 1 66 GLU C 1 67 THR N 112.60 164.20 131.80 136.21 134.38 1.49 15 0 "[ . 1 . 2]"
77 . 1 66 GLU C 1 67 THR N 1 67 THR CA 1 67 THR C -146.50 -106.50 -113.52 -142.63 -100.27 6.23 6 1 "[ .+ 1 . 2]"
78 . 1 67 THR N 1 67 THR CA 1 67 THR C 1 68 ARG N 116.90 177.90 116.11 130.29 116.77 6.11 10 2 "[ . + . -]"
79 . 1 67 THR C 1 68 ARG N 1 68 ARG CA 1 68 ARG C -123.10 -80.30 -99.05 -124.04 -80.35 0.94 17 0 "[ . 1 . 2]"
80 . 1 68 ARG N 1 68 ARG CA 1 68 ARG C 1 69 SER N 98.00 146.00 113.85 95.60 143.01 2.40 19 0 "[ . 1 . 2]"
81 . 1 68 ARG C 1 69 SER N 1 69 SER CA 1 69 SER C -153.00 -90.20 -109.45 -116.51 -137.98 1.81 3 0 "[ . 1 . 2]"
82 . 1 69 SER N 1 69 SER CA 1 69 SER C 1 70 GLU N 107.50 167.70 127.19 137.78 127.17 2.79 12 0 "[ . 1 . 2]"
83 . 1 69 SER C 1 70 GLU N 1 70 GLU CA 1 70 GLU C -151.60 -100.60 -109.92 -148.98 -95.16 5.44 1 1 "[+ . 1 . 2]"
84 . 1 70 GLU N 1 70 GLU CA 1 70 GLU C 1 71 VAL N 109.30 154.10 122.40 142.24 136.16 1.32 16 0 "[ . 1 . 2]"
85 . 1 72 ILE C 1 73 VAL N 1 73 VAL CA 1 73 VAL C 149.30 -70.70 -152.06 -160.64 -139.05 . . 0 "[ . 1 . 2]"
86 . 1 73 VAL N 1 73 VAL CA 1 73 VAL C 1 74 ALA N 110.80 159.60 128.87 120.79 110.37 0.59 13 0 "[ . 1 . 2]"
87 . 1 73 VAL C 1 74 ALA N 1 74 ALA CA 1 74 ALA C -145.00 -50.20 -137.42 -147.20 -91.05 2.20 6 0 "[ . 1 . 2]"
88 . 1 74 ALA N 1 74 ALA CA 1 74 ALA C 1 75 GLU N 106.40 148.60 110.25 105.61 104.95 3.09 12 0 "[ . 1 . 2]"
89 . 1 78 ARG C 1 79 CYS N 1 79 CYS CA 1 79 CYS C -166.80 -109.20 -157.61 -151.53 -156.36 1.07 15 0 "[ . 1 . 2]"
90 . 1 79 CYS N 1 79 CYS CA 1 79 CYS C 1 80 PHE N 98.50 164.30 132.44 94.15 158.98 4.35 9 0 "[ . 1 . 2]"
91 . 1 79 CYS C 1 80 PHE N 1 80 PHE CA 1 80 PHE C -145.40 -89.20 -130.50 -121.41 -125.95 2.84 4 0 "[ . 1 . 2]"
92 . 1 80 PHE N 1 80 PHE CA 1 80 PHE C 1 81 GLY N 105.80 155.60 109.80 118.90 112.83 3.49 18 0 "[ . 1 . 2]"
93 . 1 80 PHE C 1 81 GLY N 1 81 GLY CA 1 81 GLY C -157.60 -58.60 -128.13 -157.26 -103.57 . . 0 "[ . 1 . 2]"
94 . 1 81 GLY N 1 81 GLY CA 1 81 GLY C 1 82 TRP N 104.20 166.40 131.65 103.68 161.95 0.52 18 0 "[ . 1 . 2]"
95 . 1 81 GLY C 1 82 TRP N 1 82 TRP CA 1 82 TRP C 173.00 -100.60 -134.76 -150.81 -107.69 . . 0 "[ . 1 . 2]"
96 . 1 82 TRP N 1 82 TRP CA 1 82 TRP C 1 83 SER N 130.10 -175.90 156.63 175.33 173.49 . . 0 "[ . 1 . 2]"
97 . 1 82 TRP C 1 83 SER N 1 83 SER CA 1 83 SER C -166.90 -98.70 -118.68 -140.09 -142.32 2.33 19 0 "[ . 1 . 2]"
98 . 1 83 SER N 1 83 SER CA 1 83 SER C 1 84 VAL N 121.40 170.00 121.65 117.18 132.55 4.22 15 0 "[ . 1 . 2]"
99 . 1 83 SER C 1 84 VAL N 1 84 VAL CA 1 84 VAL C -162.60 -77.00 -77.38 -86.98 -72.75 4.25 18 0 "[ . 1 . 2]"
100 . 1 84 VAL N 1 84 VAL CA 1 84 VAL C 1 85 THR N 110.20 150.20 128.11 116.62 111.03 1.97 20 0 "[ . 1 . 2]"
101 . 1 88 ASN C 1 89 VAL N 1 89 VAL CA 1 89 VAL C -161.50 -100.90 -115.64 -108.11 -110.31 0.12 6 0 "[ . 1 . 2]"
102 . 1 89 VAL N 1 89 VAL CA 1 89 VAL C 1 90 LYS N 122.50 172.90 142.90 120.55 162.50 1.95 7 0 "[ . 1 . 2]"
103 . 1 89 VAL C 1 90 LYS N 1 90 LYS CA 1 90 LYS C -155.90 -97.70 -127.14 -152.32 -97.41 0.29 7 0 "[ . 1 . 2]"
104 . 1 90 LYS N 1 90 LYS CA 1 90 LYS C 1 91 TRP N 100.90 153.90 130.80 104.00 142.90 . . 0 "[ . 1 . 2]"
105 . 1 90 LYS C 1 91 TRP N 1 91 TRP CA 1 91 TRP C -176.10 -89.30 -121.58 -130.65 -131.51 . . 0 "[ . 1 . 2]"
106 . 1 91 TRP N 1 91 TRP CA 1 91 TRP C 1 92 ILE N 93.50 -152.50 114.73 101.19 97.92 . . 0 "[ . 1 . 2]"
107 . 1 91 TRP C 1 92 ILE N 1 92 ILE CA 1 92 ILE C -149.30 -109.30 -116.30 -137.81 -107.78 1.52 16 0 "[ . 1 . 2]"
108 . 1 92 ILE N 1 92 ILE CA 1 92 ILE C 1 93 TYR N 113.70 168.10 112.07 111.19 110.88 3.23 7 0 "[ . 1 . 2]"
109 . 1 92 ILE C 1 93 TYR N 1 93 TYR CA 1 93 TYR C -147.90 -88.70 -105.62 -105.17 -105.99 . . 0 "[ . 1 . 2]"
110 . 1 93 TYR N 1 93 TYR CA 1 93 TYR C 1 94 SER N 105.50 149.10 108.34 104.73 103.94 5.96 3 3 "[ + . - 1 . * 2]"
111 . 1 93 TYR C 1 94 SER N 1 94 SER CA 1 94 SER C -167.20 -69.40 -100.11 -147.37 -81.21 . . 0 "[ . 1 . 2]"
112 . 1 94 SER N 1 94 SER CA 1 94 SER C 1 95 MET N 126.10 167.10 132.03 127.70 126.14 3.24 16 0 "[ . 1 . 2]"
113 . 1 94 SER C 1 95 MET N 1 95 MET CA 1 95 MET C -169.10 -113.70 -122.23 -112.92 -116.46 5.31 2 1 "[ + . 1 . 2]"
114 . 1 95 MET N 1 95 MET CA 1 95 MET C 1 96 GLU N 114.50 -174.10 120.32 117.67 114.78 4.24 1 0 "[ . 1 . 2]"
115 . 1 95 MET C 1 96 GLU N 1 96 GLU CA 1 96 GLU C -165.90 -92.30 -105.13 -100.42 -104.11 3.12 10 0 "[ . 1 . 2]"
116 . 1 96 GLU N 1 96 GLU CA 1 96 GLU C 1 97 PRO N 83.90 -170.50 100.71 99.10 97.75 . . 0 "[ . 1 . 2]"
117 . 1 101 GLY C 1 102 THR N 1 102 THR CA 1 102 THR C -152.80 -99.60 -153.47 -156.30 -146.70 3.50 17 0 "[ . 1 . 2]"
118 . 1 102 THR N 1 102 THR CA 1 102 THR C 1 103 VAL N 104.90 144.90 128.21 116.99 135.13 . . 0 "[ . 1 . 2]"
119 . 1 102 THR C 1 103 VAL N 1 103 VAL CA 1 103 VAL C -135.70 -90.10 -88.48 -88.65 -89.40 3.14 3 0 "[ . 1 . 2]"
120 . 1 103 VAL N 1 103 VAL CA 1 103 VAL C 1 104 LEU N 94.10 138.50 104.77 94.96 111.34 . . 0 "[ . 1 . 2]"
121 . 1 103 VAL C 1 104 LEU N 1 104 LEU CA 1 104 LEU C -140.10 -79.90 -82.89 -82.21 -83.46 2.17 11 0 "[ . 1 . 2]"
122 . 1 104 LEU N 1 104 LEU CA 1 104 LEU C 1 105 THR N 107.00 147.00 125.49 106.51 145.08 0.49 11 0 "[ . 1 . 2]"
123 . 1 104 LEU C 1 105 THR N 1 105 THR CA 1 105 THR C -137.20 -96.40 -123.63 -119.74 -125.53 1.34 3 0 "[ . 1 . 2]"
124 . 1 105 THR N 1 105 THR CA 1 105 THR C 1 106 GLU N 107.40 147.40 111.95 106.82 106.19 3.53 9 0 "[ . 1 . 2]"
125 . 1 105 THR C 1 106 GLU N 1 106 GLU CA 1 106 GLU C -157.90 -91.70 -97.60 -88.78 -89.97 3.64 2 0 "[ . 1 . 2]"
126 . 1 106 GLU N 1 106 GLU CA 1 106 GLU C 1 107 SER N 108.40 158.00 143.45 125.22 160.18 2.18 11 0 "[ . 1 . 2]"
127 . 1 106 GLU C 1 107 SER N 1 107 SER CA 1 107 SER C -140.40 -97.20 -138.06 -136.99 -139.45 3.43 5 0 "[ . 1 . 2]"
128 . 1 107 SER N 1 107 SER CA 1 107 SER C 1 108 TRP N 109.80 169.60 108.75 101.68 155.61 8.12 2 5 "[ + *.** -1 . 2]"
129 . 1 107 SER C 1 108 TRP N 1 108 TRP CA 1 108 TRP C -159.00 -86.80 -92.43 -86.91 -88.58 2.84 5 0 "[ . 1 . 2]"
130 . 1 108 TRP N 1 108 TRP CA 1 108 TRP C 1 109 GLU N 111.70 153.70 127.60 126.47 122.67 2.46 15 0 "[ . 1 . 2]"
131 . 1 108 TRP C 1 109 GLU N 1 109 GLU CA 1 109 GLU C -153.90 -83.50 -133.01 -155.31 -115.99 1.41 14 0 "[ . 1 . 2]"
132 . 1 109 GLU N 1 109 GLU CA 1 109 GLU C 1 110 PHE N 92.90 147.90 117.43 115.88 110.52 3.07 19 0 "[ . 1 . 2]"
133 . 1 109 GLU C 1 110 PHE N 1 110 PHE CA 1 110 PHE C -124.90 -84.90 -101.05 -127.50 -80.29 4.61 18 0 "[ . 1 . 2]"
134 . 1 110 PHE N 1 110 PHE CA 1 110 PHE C 1 111 THR N 84.30 150.90 113.57 87.83 151.56 0.66 5 0 "[ . 1 . 2]"
135 . 1 110 PHE C 1 111 THR N 1 111 THR CA 1 111 THR C -90.70 -45.50 -74.06 -76.91 -80.05 2.68 9 0 "[ . 1 . 2]"
136 . 1 111 THR N 1 111 THR CA 1 111 THR C 1 112 PRO N 111.30 170.70 145.84 113.72 166.27 . . 0 "[ . 1 . 2]"
137 . 1 113 LYS C 1 114 GLY N 1 114 GLY CA 1 114 GLY C -80.70 -40.70 -69.48 -71.19 -73.02 1.23 14 0 "[ . 1 . 2]"
138 . 1 114 GLY N 1 114 GLY CA 1 114 GLY C 1 115 GLN N -59.90 -19.90 -33.05 -52.71 -16.62 3.28 5 0 "[ . 1 . 2]"
139 . 1 114 GLY C 1 115 GLN N 1 115 GLN CA 1 115 GLN C -85.10 -45.10 -62.94 -71.44 -50.69 . . 0 "[ . 1 . 2]"
140 . 1 115 GLN N 1 115 GLN CA 1 115 GLN C 1 116 ARG N -59.80 -19.80 -38.10 -24.34 -30.11 3.56 2 0 "[ . 1 . 2]"
141 . 1 115 GLN C 1 116 ARG N 1 116 ARG CA 1 116 ARG C -80.10 -40.10 -64.10 -72.38 -53.11 . . 0 "[ . 1 . 2]"
142 . 1 116 ARG N 1 116 ARG CA 1 116 ARG C 1 117 PHE N -61.40 -21.40 -35.52 -54.90 -20.67 0.73 5 0 "[ . 1 . 2]"
143 . 1 116 ARG C 1 117 PHE N 1 117 PHE CA 1 117 PHE C -84.40 -44.40 -61.06 -69.15 -44.92 . . 0 "[ . 1 . 2]"
144 . 1 117 PHE N 1 117 PHE CA 1 117 PHE C 1 118 PHE N -63.40 -23.40 -47.08 -58.16 -32.65 . . 0 "[ . 1 . 2]"
145 . 1 117 PHE C 1 118 PHE N 1 118 PHE CA 1 118 PHE C -87.60 -47.60 -70.95 -80.42 -85.64 . . 0 "[ . 1 . 2]"
146 . 1 118 PHE N 1 118 PHE CA 1 118 PHE C 1 119 HIS N -57.50 -17.50 -31.94 -33.39 -38.26 0.99 9 0 "[ . 1 . 2]"
147 . 1 118 PHE C 1 119 HIS N 1 119 HIS CA 1 119 HIS C -85.90 -45.90 -71.36 -83.66 -56.49 . . 0 "[ . 1 . 2]"
148 . 1 119 HIS N 1 119 HIS CA 1 119 HIS C 1 120 ASP N -63.90 -23.90 -34.28 -26.58 -28.81 2.35 3 0 "[ . 1 . 2]"
149 . 1 119 HIS C 1 120 ASP N 1 120 ASP CA 1 120 ASP C -86.40 -46.40 -74.73 -86.69 -60.20 0.29 18 0 "[ . 1 . 2]"
150 . 1 120 ASP N 1 120 ASP CA 1 120 ASP C 1 121 LYS N -57.70 -17.70 -37.62 -57.12 -17.24 0.46 1 0 "[ . 1 . 2]"
151 . 1 123 GLY C 1 124 ASP N 1 124 ASP CA 1 124 ASP C -86.90 -46.90 -67.96 -87.96 -46.21 1.06 19 0 "[ . 1 . 2]"
152 . 1 124 ASP N 1 124 ASP CA 1 124 ASP C 1 125 LYS N -54.40 5.20 -42.63 -44.77 -47.47 1.69 14 0 "[ . 1 . 2]"
153 . 1 124 ASP C 1 125 LYS N 1 125 LYS CA 1 125 LYS C -127.40 -45.60 -79.87 -118.27 -50.25 . . 0 "[ . 1 . 2]"
154 . 1 125 LYS N 1 125 LYS CA 1 125 LYS C 1 126 SER N -56.90 30.70 -8.74 4.82 -4.00 . . 0 "[ . 1 . 2]"
155 . 1 125 LYS C 1 126 SER N 1 126 SER CA 1 126 SER C -84.70 -44.70 -63.94 -73.73 -85.49 1.52 5 0 "[ . 1 . 2]"
156 . 1 126 SER N 1 126 SER CA 1 126 SER C 1 127 ILE N -56.60 -16.60 -29.06 -44.26 -11.61 4.99 1 0 "[ . 1 . 2]"
157 . 1 126 SER C 1 127 ILE N 1 127 ILE CA 1 127 ILE C -82.50 -42.50 -64.55 -74.40 -49.79 . . 0 "[ . 1 . 2]"
158 . 1 127 ILE N 1 127 ILE CA 1 127 ILE C 1 128 GLU N -66.30 -26.30 -43.77 -51.95 -36.87 . . 0 "[ . 1 . 2]"
159 . 1 127 ILE C 1 128 GLU N 1 128 GLU CA 1 128 GLU C -82.90 -42.90 -68.41 -83.69 -58.78 0.79 13 0 "[ . 1 . 2]"
160 . 1 128 GLU N 1 128 GLU CA 1 128 GLU C 1 129 GLU N -59.10 -19.10 -38.47 -26.96 -31.88 0.49 13 0 "[ . 1 . 2]"
161 . 1 128 GLU C 1 129 GLU N 1 129 GLU CA 1 129 GLU C -85.70 -45.70 -64.29 -67.44 -67.59 . . 0 "[ . 1 . 2]"
162 . 1 129 GLU N 1 129 GLU CA 1 129 GLU C 1 130 ILE N -59.90 -19.90 -48.06 -60.04 -35.38 0.14 15 0 "[ . 1 . 2]"
163 . 1 129 GLU C 1 130 ILE N 1 130 ILE CA 1 130 ILE C -85.40 -45.40 -68.72 -75.34 -76.38 . . 0 "[ . 1 . 2]"
164 . 1 130 ILE N 1 130 ILE CA 1 130 ILE C 1 131 GLU N -63.50 -23.50 -32.65 -26.41 -29.27 0.55 14 0 "[ . 1 . 2]"
165 . 1 130 ILE C 1 131 GLU N 1 131 GLU CA 1 131 GLU C -80.60 -40.60 -68.87 -69.44 -70.64 . . 0 "[ . 1 . 2]"
166 . 1 131 GLU N 1 131 GLU CA 1 131 GLU C 1 132 LYS N -64.60 -24.60 -49.85 -62.27 -33.06 . . 0 "[ . 1 . 2]"
167 . 1 131 GLU C 1 132 LYS N 1 132 LYS CA 1 132 LYS C -83.00 -43.00 -62.17 -54.76 -58.28 . . 0 "[ . 1 . 2]"
168 . 1 132 LYS N 1 132 LYS CA 1 132 LYS C 1 133 ARG N -61.30 -21.30 -40.30 -37.47 -41.17 . . 0 "[ . 1 . 2]"
169 . 1 132 LYS C 1 133 ARG N 1 133 ARG CA 1 133 ARG C -89.10 -49.10 -70.25 -62.89 -65.03 . . 0 "[ . 1 . 2]"
170 . 1 133 ARG N 1 133 ARG CA 1 133 ARG C 1 134 ARG N -61.30 -21.30 -37.31 -62.11 -21.07 0.81 2 0 "[ . 1 . 2]"
171 . 1 133 ARG C 1 134 ARG N 1 134 ARG CA 1 134 ARG C -83.10 -43.10 -67.56 -78.33 -60.46 . . 0 "[ . 1 . 2]"
172 . 1 134 ARG N 1 134 ARG CA 1 134 ARG C 1 135 LEU N -65.50 -25.50 -47.12 -42.58 -44.35 . . 0 "[ . 1 . 2]"
173 . 1 134 ARG C 1 135 LEU N 1 135 LEU CA 1 135 LEU C -77.90 -37.90 -66.92 -76.44 -58.15 . . 0 "[ . 1 . 2]"
174 . 1 135 LEU N 1 135 LEU CA 1 135 LEU C 1 136 ALA N -62.40 -22.40 -42.05 -55.90 -30.82 . . 0 "[ . 1 . 2]"
175 . 1 135 LEU C 1 136 ALA N 1 136 ALA CA 1 136 ALA C -83.10 -43.10 -64.55 -66.38 -68.54 . . 0 "[ . 1 . 2]"
176 . 1 136 ALA N 1 136 ALA CA 1 136 ALA C 1 137 ALA N -60.00 -20.00 -30.53 -42.64 -20.68 . . 0 "[ . 1 . 2]"
177 . 1 136 ALA C 1 137 ALA N 1 137 ALA CA 1 137 ALA C -83.70 -43.70 -77.85 -78.48 -82.43 1.10 16 0 "[ . 1 . 2]"
178 . 1 137 ALA N 1 137 ALA CA 1 137 ALA C 1 138 ILE N -63.90 -23.90 -49.29 -68.51 -34.99 4.61 15 0 "[ . 1 . 2]"
179 . 1 137 ALA C 1 138 ILE N 1 138 ILE CA 1 138 ILE C -90.90 -45.70 -64.10 -63.39 -64.32 . . 0 "[ . 1 . 2]"
180 . 1 138 ILE N 1 138 ILE CA 1 138 ILE C 1 139 THR N -66.00 -26.00 -28.69 -24.26 -24.78 2.29 2 0 "[ . 1 . 2]"
181 . 1 138 ILE C 1 139 THR N 1 139 THR CA 1 139 THR C -96.20 -44.20 -86.67 -90.22 -96.36 1.60 17 0 "[ . 1 . 2]"
182 . 1 139 THR N 1 139 THR CA 1 139 THR C 1 140 GLY N -58.10 -18.10 -41.27 -54.54 -28.88 . . 0 "[ . 1 . 2]"
183 . 1 139 THR C 1 140 GLY N 1 140 GLY CA 1 140 GLY C -93.40 -50.20 -74.54 -85.04 -63.90 . . 0 "[ . 1 . 2]"
184 . 1 140 GLY N 1 140 GLY CA 1 140 GLY C 1 141 ILE N -58.50 -18.50 -42.35 -33.47 -37.06 1.76 4 0 "[ . 1 . 2]"
185 . 1 140 GLY C 1 141 ILE N 1 141 ILE CA 1 141 ILE C -78.50 -36.70 -61.38 -70.79 -53.39 . . 0 "[ . 1 . 2]"
186 . 1 141 ILE N 1 141 ILE CA 1 141 ILE C 1 142 PRO N -64.00 -24.00 -55.30 -51.87 -52.36 . . 0 "[ . 1 . 2]"
187 . 1 142 PRO C 1 143 GLU N 1 143 GLU CA 1 143 GLU C -90.00 -50.00 -64.94 -72.40 -53.65 . . 0 "[ . 1 . 2]"
188 . 1 143 GLU N 1 143 GLU CA 1 143 GLU C 1 144 THR N -58.60 -18.60 -42.15 -43.61 -47.85 . . 0 "[ . 1 . 2]"
189 . 1 143 GLU C 1 144 THR N 1 144 THR CA 1 144 THR C -85.00 -45.00 -65.96 -63.96 -64.80 . . 0 "[ . 1 . 2]"
190 . 1 144 THR N 1 144 THR CA 1 144 THR C 1 145 LEU N -65.30 -25.30 -41.53 -46.25 -31.61 . . 0 "[ . 1 . 2]"
191 . 1 144 THR C 1 145 LEU N 1 145 LEU CA 1 145 LEU C -82.00 -42.00 -60.11 -69.79 -54.78 . . 0 "[ . 1 . 2]"
192 . 1 145 LEU N 1 145 LEU CA 1 145 LEU C 1 146 VAL N -63.50 -23.50 -47.27 -53.22 -41.20 . . 0 "[ . 1 . 2]"
193 . 1 145 LEU C 1 146 VAL N 1 146 VAL CA 1 146 VAL C -84.10 -44.10 -67.62 -69.94 -69.94 . . 0 "[ . 1 . 2]"
194 . 1 146 VAL N 1 146 VAL CA 1 146 VAL C 1 147 ALA N -60.40 -20.40 -34.15 -32.83 -33.65 . . 0 "[ . 1 . 2]"
195 . 1 146 VAL C 1 147 ALA N 1 147 ALA CA 1 147 ALA C -82.30 -42.30 -67.89 -78.03 -61.00 . . 0 "[ . 1 . 2]"
196 . 1 147 ALA N 1 147 ALA CA 1 147 ALA C 1 148 ILE N -62.00 -22.00 -41.52 -56.03 -26.27 . . 0 "[ . 1 . 2]"
197 . 1 147 ALA C 1 148 ILE N 1 148 ILE CA 1 148 ILE C -85.70 -45.70 -64.82 -59.43 -61.77 . . 0 "[ . 1 . 2]"
198 . 1 148 ILE N 1 148 ILE CA 1 148 ILE C 1 149 GLN N -62.70 -22.70 -43.89 -45.69 -46.38 . . 0 "[ . 1 . 2]"
199 . 1 148 ILE C 1 149 GLN N 1 149 GLN CA 1 149 GLN C -81.90 -41.90 -61.61 -71.75 -53.09 . . 0 "[ . 1 . 2]"
200 . 1 149 GLN N 1 149 GLN CA 1 149 GLN C 1 150 ARG N -59.90 -19.90 -51.79 -60.83 -43.88 0.93 5 0 "[ . 1 . 2]"
201 . 1 149 GLN C 1 150 ARG N 1 150 ARG CA 1 150 ARG C -81.30 -41.30 -63.54 -59.26 -63.92 . . 0 "[ . 1 . 2]"
202 . 1 150 ARG N 1 150 ARG CA 1 150 ARG C 1 151 ILE N -65.60 -25.60 -46.60 -45.44 -47.55 . . 0 "[ . 1 . 2]"
203 . 1 150 ARG C 1 151 ILE N 1 151 ILE CA 1 151 ILE C -87.50 -47.50 -63.75 -74.19 -53.72 . . 0 "[ . 1 . 2]"
204 . 1 151 ILE N 1 151 ILE CA 1 151 ILE C 1 152 LEU N -63.30 -23.30 -35.13 -48.43 -29.22 . . 0 "[ . 1 . 2]"
205 . 1 151 ILE C 1 152 LEU N 1 152 LEU CA 1 152 LEU C -85.50 -42.30 -70.78 -80.40 -61.47 . . 0 "[ . 1 . 2]"
206 . 1 152 LEU N 1 152 LEU CA 1 152 LEU C 1 153 GLU N -59.40 -8.40 -40.97 -36.90 -42.63 . . 0 "[ . 1 . 2]"
207 . 1 152 LEU C 1 153 GLU N 1 153 GLU CA 1 153 GLU C -84.70 -44.70 -66.36 -68.52 -68.99 . . 0 "[ . 1 . 2]"
208 . 1 153 GLU N 1 153 GLU CA 1 153 GLU C 1 154 VAL N -60.50 -20.50 -38.15 -47.24 -26.94 . . 0 "[ . 1 . 2]"
209 . 1 153 GLU C 1 154 VAL N 1 154 VAL CA 1 154 VAL C -83.30 -43.30 -66.80 -65.29 -65.89 . . 0 "[ . 1 . 2]"
210 . 1 154 VAL N 1 154 VAL CA 1 154 VAL C 1 155 GLU N -61.30 -21.30 -37.52 -45.84 -30.00 . . 0 "[ . 1 . 2]"
211 . 1 154 VAL C 1 155 GLU N 1 155 GLU CA 1 155 GLU C -82.80 -42.80 -71.04 -71.49 -72.79 1.36 8 0 "[ . 1 . 2]"
212 . 1 155 GLU N 1 155 GLU CA 1 155 GLU C 1 156 LEU N -65.70 -4.70 -26.73 -27.01 -29.64 . . 0 "[ . 1 . 2]"
213 . 1 155 GLU C 1 156 LEU N 1 156 LEU CA 1 156 LEU C -87.00 -47.00 -72.71 -63.78 -67.42 . . 0 "[ . 1 . 2]"
214 . 1 156 LEU N 1 156 LEU CA 1 156 LEU C 1 157 GLU N -60.10 -11.10 -34.39 -64.88 -11.94 4.78 15 0 "[ . 1 . 2]"
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