NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
619928 |
5ms9   |
19078 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5ms9
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 161
_TA_constraint_stats_list.Viol_count 474
_TA_constraint_stats_list.Viol_total 22945.04
_TA_constraint_stats_list.Viol_max 17.34
_TA_constraint_stats_list.Viol_rms 1.28
_TA_constraint_stats_list.Viol_average_all_restraints 0.36
_TA_constraint_stats_list.Viol_average_violations_only 2.42
_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 9 CYS C 1 10 ASN N 1 10 ASN CA 1 10 ASN C -121.90 -68.50 -113.26 -107.08 -110.47 7.01 20 1 "[ . 1 . +]"
2 . 1 10 ASN N 1 10 ASN CA 1 10 ASN C 1 11 ILE N -68.40 13.40 -44.10 -62.94 -11.56 . . 0 "[ . 1 . 2]"
3 . 1 11 ILE C 1 12 ARG N 1 12 ARG CA 1 12 ARG C -127.50 -55.30 -114.14 -130.27 -52.28 3.02 7 0 "[ . 1 . 2]"
4 . 1 12 ARG N 1 12 ARG CA 1 12 ARG C 1 13 CYS N 101.60 160.60 133.11 104.54 156.61 . . 0 "[ . 1 . 2]"
5 . 1 12 ARG C 1 13 CYS N 1 13 CYS CA 1 13 CYS C -116.10 -76.10 -115.30 -118.93 -100.47 2.83 20 0 "[ . 1 . 2]"
6 . 1 13 CYS N 1 13 CYS CA 1 13 CYS C 1 14 MET N 54.70 179.90 136.74 139.46 137.02 . . 0 "[ . 1 . 2]"
7 . 1 14 MET C 1 15 ASN N 1 15 ASN CA 1 15 ASN C 32.50 72.50 66.13 66.17 65.57 . . 0 "[ . 1 . 2]"
8 . 1 15 ASN N 1 15 ASN CA 1 15 ASN C 1 16 GLY N 14.60 54.60 48.47 37.27 55.91 1.31 6 0 "[ . 1 . 2]"
9 . 1 15 ASN C 1 16 GLY N 1 16 GLY CA 1 16 GLY C 50.70 119.50 70.12 59.60 82.37 . . 0 "[ . 1 . 2]"
10 . 1 16 GLY N 1 16 GLY CA 1 16 GLY C 1 17 GLY N -31.00 40.00 25.53 24.63 22.17 . . 0 "[ . 1 . 2]"
11 . 1 17 GLY C 1 18 SER N 1 18 SER CA 1 18 SER C -164.20 -58.40 -94.08 -127.03 -72.19 . . 0 "[ . 1 . 2]"
12 . 1 18 SER N 1 18 SER CA 1 18 SER C 1 19 CYS N 127.20 168.60 135.57 146.32 134.39 3.54 12 0 "[ . 1 . 2]"
13 . 1 18 SER C 1 19 CYS N 1 19 CYS CA 1 19 CYS C -145.80 -59.00 -79.42 -99.76 -58.76 0.24 17 0 "[ . 1 . 2]"
14 . 1 19 CYS N 1 19 CYS CA 1 19 CYS C 1 20 SER N 80.50 170.30 118.91 122.07 118.73 2.90 16 0 "[ . 1 . 2]"
15 . 1 19 CYS C 1 20 SER N 1 20 SER CA 1 20 SER C -140.30 -47.10 -132.33 -141.65 -142.33 4.03 10 0 "[ . 1 . 2]"
16 . 1 20 SER N 1 20 SER CA 1 20 SER C 1 21 ASP N 90.60 175.60 147.10 104.92 -176.79 7.61 14 1 "[ . 1 +. 2]"
17 . 1 23 HIS C 1 24 CYS N 1 24 CYS CA 1 24 CYS C -122.10 -69.50 -100.33 -123.19 -69.04 1.09 4 0 "[ . 1 . 2]"
18 . 1 24 CYS N 1 24 CYS CA 1 24 CYS C 1 25 LEU N 108.20 158.00 142.45 124.05 160.55 2.55 5 0 "[ . 1 . 2]"
19 . 1 27 GLN C 1 28 LYS N 1 28 LYS CA 1 28 LYS C -82.60 -35.20 -63.15 -62.45 -62.90 . . 0 "[ . 1 . 2]"
20 . 1 28 LYS N 1 28 LYS CA 1 28 LYS C 1 29 GLY N 113.90 156.50 113.70 109.11 134.42 4.79 5 0 "[ . 1 . 2]"
21 . 1 29 GLY C 1 30 TYR N 1 30 TYR CA 1 30 TYR C 173.80 -71.20 -122.30 -130.63 -115.55 . . 0 "[ . 1 . 2]"
22 . 1 30 TYR N 1 30 TYR CA 1 30 TYR C 1 31 ILE N 138.70 178.70 148.04 138.88 162.16 . . 0 "[ . 1 . 2]"
23 . 1 30 TYR C 1 31 ILE N 1 31 ILE CA 1 31 ILE C -179.60 -72.20 -134.72 -141.41 -126.90 . . 0 "[ . 1 . 2]"
24 . 1 31 ILE N 1 31 ILE CA 1 31 ILE C 1 32 GLY N 130.30 -165.10 -179.31 -178.15 178.42 . . 0 "[ . 1 . 2]"
25 . 1 32 GLY C 1 33 THR N 1 33 THR CA 1 33 THR C -77.40 -37.40 -72.71 -78.16 -61.66 0.76 9 0 "[ . 1 . 2]"
26 . 1 33 THR N 1 33 THR CA 1 33 THR C 1 34 HIS N -50.10 -10.10 -33.82 -34.71 -36.93 . . 0 "[ . 1 . 2]"
27 . 1 33 THR C 1 34 HIS N 1 34 HIS CA 1 34 HIS C -110.60 -68.00 -104.26 -111.35 -88.04 0.75 3 0 "[ . 1 . 2]"
28 . 1 37 GLN N 1 37 GLN CA 1 37 GLN C 1 38 PRO N 85.10 171.50 112.08 97.59 126.62 . . 0 "[ . 1 . 2]"
29 . 1 37 GLN C 1 38 PRO N 1 38 PRO CA 1 38 PRO C -92.40 -52.40 -81.66 -77.89 -79.69 . . 0 "[ . 1 . 2]"
30 . 1 38 PRO N 1 38 PRO CA 1 38 PRO C 1 39 VAL N 122.80 168.60 143.88 147.85 143.87 . . 0 "[ . 1 . 2]"
31 . 1 38 PRO C 1 39 VAL N 1 39 VAL CA 1 39 VAL C -119.70 -48.70 -74.51 -97.23 -66.47 . . 0 "[ . 1 . 2]"
32 . 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 40 CYS N 106.00 -179.00 108.64 102.89 122.51 3.11 12 0 "[ . 1 . 2]"
33 . 1 39 VAL C 1 40 CYS N 1 40 CYS CA 1 40 CYS C -78.50 -38.50 -80.64 -80.73 -81.44 5.14 12 1 "[ . 1 + . 2]"
34 . 1 42 SER N 1 42 SER CA 1 42 SER C 1 43 GLY N -37.70 28.30 13.92 7.02 27.04 . . 0 "[ . 1 . 2]"
35 . 1 45 LEU C 1 46 ASN N 1 46 ASN CA 1 46 ASN C 36.60 76.60 50.07 42.43 36.49 1.17 1 0 "[ . 1 . 2]"
36 . 1 46 ASN N 1 46 ASN CA 1 46 ASN C 1 47 GLY N 12.40 52.40 23.99 10.33 38.07 2.07 12 0 "[ . 1 . 2]"
37 . 1 46 ASN C 1 47 GLY N 1 47 GLY CA 1 47 GLY C 48.10 131.90 63.40 64.05 63.31 . . 0 "[ . 1 . 2]"
38 . 1 47 GLY N 1 47 GLY CA 1 47 GLY C 1 48 GLY N -32.10 36.50 36.50 36.26 35.54 2.87 4 0 "[ . 1 . 2]"
39 . 1 48 GLY C 1 49 ARG N 1 49 ARG CA 1 49 ARG C -171.60 -96.40 -149.02 -154.28 -155.55 2.13 15 0 "[ . 1 . 2]"
40 . 1 49 ARG N 1 49 ARG CA 1 49 ARG C 1 50 CYS N 105.80 169.40 124.26 114.13 140.68 . . 0 "[ . 1 . 2]"
41 . 1 49 ARG C 1 50 CYS N 1 50 CYS CA 1 50 CYS C -130.20 -46.40 -65.53 -58.99 -60.94 . . 0 "[ . 1 . 2]"
42 . 1 50 CYS N 1 50 CYS CA 1 50 CYS C 1 51 VAL N 110.80 150.80 117.27 125.24 124.56 2.46 20 0 "[ . 1 . 2]"
43 . 1 51 VAL C 1 52 ALA N 1 52 ALA CA 1 52 ALA C -132.60 -32.00 -137.10 -140.63 -127.70 8.03 2 12 "[*+ *.- ** ****** 2]"
44 . 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 PRO N 66.10 -155.10 173.47 170.55 169.62 . . 0 "[ . 1 . 2]"
45 . 1 53 PRO C 1 54 ASN N 1 54 ASN CA 1 54 ASN C 32.90 114.70 70.95 76.53 75.28 . . 0 "[ . 1 . 2]"
46 . 1 54 ASN N 1 54 ASN CA 1 54 ASN C 1 55 ARG N -52.80 75.80 1.53 -18.33 16.17 . . 0 "[ . 1 . 2]"
47 . 1 55 ARG C 1 56 CYS N 1 56 CYS CA 1 56 CYS C -147.90 -71.90 -83.69 -83.06 -84.12 0.22 10 0 "[ . 1 . 2]"
48 . 1 56 CYS N 1 56 CYS CA 1 56 CYS C 1 57 ALA N 107.50 155.70 144.39 145.80 145.33 . . 0 "[ . 1 . 2]"
49 . 1 56 CYS C 1 57 ALA N 1 57 ALA CA 1 57 ALA C -148.40 -57.40 -94.12 -90.52 -92.38 . . 0 "[ . 1 . 2]"
50 . 1 57 ALA N 1 57 ALA CA 1 57 ALA C 1 58 CYS N 84.50 158.70 128.59 106.91 147.86 . . 0 "[ . 1 . 2]"
51 . 1 58 CYS C 1 59 THR N 1 59 THR CA 1 59 THR C -110.90 -37.70 -55.57 -55.21 -56.16 . . 0 "[ . 1 . 2]"
52 . 1 59 THR N 1 59 THR CA 1 59 THR C 1 60 TYR N -54.20 25.40 -53.92 -57.59 -41.43 3.39 12 0 "[ . 1 . 2]"
53 . 1 61 GLY C 1 62 PHE N 1 62 PHE CA 1 62 PHE C -172.20 -69.00 -122.07 -129.63 -116.79 . . 0 "[ . 1 . 2]"
54 . 1 62 PHE N 1 62 PHE CA 1 62 PHE C 1 63 THR N 122.60 178.00 128.84 123.91 122.24 1.35 1 0 "[ . 1 . 2]"
55 . 1 62 PHE C 1 63 THR N 1 63 THR CA 1 63 THR C 177.30 -88.50 -90.55 -103.40 -86.36 2.14 20 0 "[ . 1 . 2]"
56 . 1 63 THR N 1 63 THR CA 1 63 THR C 1 64 GLY N 119.30 -156.90 143.85 141.44 140.11 0.06 3 0 "[ . 1 . 2]"
57 . 1 66 GLN N 1 66 GLN CA 1 66 GLN C 1 67 CYS N -31.80 26.40 11.32 -6.34 26.10 . . 0 "[ . 1 . 2]"
58 . 1 67 CYS C 1 68 GLU N 1 68 GLU CA 1 68 GLU C -126.70 -53.90 -114.25 -112.42 -113.84 . . 0 "[ . 1 . 2]"
59 . 1 68 GLU N 1 68 GLU CA 1 68 GLU C 1 69 ARG N -62.60 47.80 5.82 22.05 21.00 . . 0 "[ . 1 . 2]"
60 . 1 70 ASP C 1 71 TYR N 1 71 TYR CA 1 71 TYR C -157.90 -51.50 -99.90 -85.60 -86.13 . . 0 "[ . 1 . 2]"
61 . 1 71 TYR N 1 71 TYR CA 1 71 TYR C 1 72 ARG N 78.90 172.30 79.78 61.56 108.78 17.34 19 8 "[ *.* * * * - +*]"
62 . 1 72 ARG C 1 73 THR N 1 73 THR CA 1 73 THR C 170.90 -79.50 -83.11 -98.76 -72.25 7.25 12 2 "[ . - 1 + . 2]"
63 . 1 73 THR N 1 73 THR CA 1 73 THR C 1 74 GLY N 140.30 -179.70 141.96 137.73 137.39 6.02 11 3 "[ * - 1+ . 2]"
64 . 1 74 GLY C 1 75 PRO N 1 75 PRO CA 1 75 PRO C -87.00 -47.00 -75.83 -85.07 -59.92 . . 0 "[ . 1 . 2]"
65 . 1 75 PRO N 1 75 PRO CA 1 75 PRO C 1 76 CYS N 129.50 169.50 136.30 139.87 136.24 1.27 17 0 "[ . 1 . 2]"
66 . 1 76 CYS C 1 77 PHE N 1 77 PHE CA 1 77 PHE C -138.10 -39.10 -96.63 -110.32 -84.54 . . 0 "[ . 1 . 2]"
67 . 1 77 PHE N 1 77 PHE CA 1 77 PHE C 1 78 THR N 60.40 -161.00 147.43 143.43 138.93 . . 0 "[ . 1 . 2]"
68 . 1 77 PHE C 1 78 THR N 1 78 THR CA 1 78 THR C -136.50 -54.30 -108.96 -129.28 -89.32 . . 0 "[ . 1 . 2]"
69 . 1 78 THR N 1 78 THR CA 1 78 THR C 1 79 VAL N -57.10 13.50 -23.20 -16.11 -18.24 2.42 14 0 "[ . 1 . 2]"
70 . 1 78 THR C 1 79 VAL N 1 79 VAL CA 1 79 VAL C -167.40 -99.60 -151.37 -145.66 -149.47 3.35 19 0 "[ . 1 . 2]"
71 . 1 79 VAL N 1 79 VAL CA 1 79 VAL C 1 80 ILE N 118.60 -166.40 121.87 114.35 174.37 4.25 2 0 "[ . 1 . 2]"
72 . 1 79 VAL C 1 80 ILE N 1 80 ILE CA 1 80 ILE C -138.70 -80.90 -122.43 -134.87 -83.71 . . 0 "[ . 1 . 2]"
73 . 1 80 ILE N 1 80 ILE CA 1 80 ILE C 1 81 SER N 120.10 160.10 119.24 114.21 127.07 5.89 16 1 "[ . 1 .+ 2]"
74 . 1 80 ILE C 1 81 SER N 1 81 SER CA 1 81 SER C -136.00 -20.80 -119.03 -116.15 -116.56 7.55 12 3 "[ . * 1 + .- 2]"
75 . 1 81 SER N 1 81 SER CA 1 81 SER C 1 82 ASN N 113.30 -168.70 -176.94 127.93 -163.61 5.09 11 1 "[ . 1+ . 2]"
76 . 1 81 SER C 1 82 ASN N 1 82 ASN CA 1 82 ASN C -107.30 -25.70 -66.00 -79.37 -50.43 . . 0 "[ . 1 . 2]"
77 . 1 82 ASN N 1 82 ASN CA 1 82 ASN C 1 83 GLN N -55.70 -6.50 -9.26 -5.18 -5.29 2.47 15 0 "[ . 1 . 2]"
78 . 1 82 ASN C 1 83 GLN N 1 83 GLN CA 1 83 GLN C -98.20 -49.40 -79.07 -78.21 -83.58 . . 0 "[ . 1 . 2]"
79 . 1 83 GLN N 1 83 GLN CA 1 83 GLN C 1 84 MET N -75.50 17.10 -70.28 -77.45 -38.80 1.95 14 0 "[ . 1 . 2]"
80 . 1 84 MET C 1 85 CYS N 1 85 CYS CA 1 85 CYS C -90.60 -40.40 -82.98 -89.52 -90.15 1.43 1 0 "[ . 1 . 2]"
81 . 1 85 CYS N 1 85 CYS CA 1 85 CYS C 1 86 GLN N -70.60 0.20 -24.90 -21.10 -23.91 1.04 12 0 "[ . 1 . 2]"
82 . 1 86 GLN C 1 87 GLY N 1 87 GLY CA 1 87 GLY C 56.20 121.60 105.45 126.12 125.78 6.18 6 1 "[ .+ 1 . 2]"
83 . 1 87 GLY N 1 87 GLY CA 1 87 GLY C 1 88 GLN N -51.20 37.40 -12.16 -52.78 21.25 1.58 14 0 "[ . 1 . 2]"
84 . 1 91 GLY C 1 92 ILE N 1 92 ILE CA 1 92 ILE C -150.30 -61.10 -63.77 -67.72 -72.97 1.01 2 0 "[ . 1 . 2]"
85 . 1 92 ILE N 1 92 ILE CA 1 92 ILE C 1 93 VAL N 93.40 150.60 105.96 91.58 121.50 1.82 17 0 "[ . 1 . 2]"
86 . 1 92 ILE C 1 93 VAL N 1 93 VAL CA 1 93 VAL C -157.40 -72.80 -95.63 -90.07 -91.39 . . 0 "[ . 1 . 2]"
87 . 1 93 VAL N 1 93 VAL CA 1 93 VAL C 1 94 SER N 103.30 176.50 107.81 95.11 124.10 8.19 2 6 "[ + *. - ** *2]"
88 . 1 93 VAL C 1 94 SER N 1 94 SER CA 1 94 SER C -156.40 -79.80 -139.62 -137.64 -151.68 1.71 9 0 "[ . 1 . 2]"
89 . 1 94 SER N 1 94 SER CA 1 94 SER C 1 95 THR N 133.10 176.70 -178.41 177.33 -175.22 8.08 12 9 "[* *.* **1 +* .- *]"
90 . 1 94 SER C 1 95 THR N 1 95 THR CA 1 95 THR C -137.20 -31.20 -103.11 -108.24 -96.46 . . 0 "[ . 1 . 2]"
91 . 1 95 THR N 1 95 THR CA 1 95 THR C 1 96 LYS N 136.60 -172.80 163.24 165.29 164.40 . . 0 "[ . 1 . 2]"
92 . 1 95 THR C 1 96 LYS N 1 96 LYS CA 1 96 LYS C -80.40 -40.40 -60.81 -69.58 -56.11 . . 0 "[ . 1 . 2]"
93 . 1 96 LYS N 1 96 LYS CA 1 96 LYS C 1 97 THR N -57.20 -17.20 -40.38 -42.26 -42.83 . . 0 "[ . 1 . 2]"
94 . 1 96 LYS C 1 97 THR N 1 97 THR CA 1 97 THR C -83.70 -43.70 -47.62 -59.94 -43.58 0.12 1 0 "[ . 1 . 2]"
95 . 1 97 THR N 1 97 THR CA 1 97 THR C 1 98 LEU N -60.70 -18.90 -55.11 -53.07 -54.47 . . 0 "[ . 1 . 2]"
96 . 1 97 THR C 1 98 LEU N 1 98 LEU CA 1 98 LEU C -82.90 -42.90 -57.73 -64.27 -53.77 . . 0 "[ . 1 . 2]"
97 . 1 98 LEU N 1 98 LEU CA 1 98 LEU C 1 99 CYS N -61.30 -21.30 -53.55 -49.68 -51.36 0.99 6 0 "[ . 1 . 2]"
98 . 1 98 LEU C 1 99 CYS N 1 99 CYS CA 1 99 CYS C -82.20 -42.20 -68.67 -77.49 -52.50 . . 0 "[ . 1 . 2]"
99 . 1 99 CYS N 1 99 CYS CA 1 99 CYS C 1 100 CYS N -63.20 -23.20 -24.93 -24.15 -26.62 5.80 16 2 "[ . 1 .+ -2]"
100 . 1 99 CYS C 1 100 CYS N 1 100 CYS CA 1 100 CYS C -114.50 -46.50 -92.26 -81.18 -83.86 . . 0 "[ . 1 . 2]"
101 . 1 101 ALA N 1 101 ALA CA 1 101 ALA C 1 102 THR N -61.80 22.60 -55.78 -52.75 -54.44 . . 0 "[ . 1 . 2]"
102 . 1 101 ALA C 1 102 THR N 1 102 THR CA 1 102 THR C 177.70 -61.10 -94.48 -106.01 -61.77 . . 0 "[ . 1 . 2]"
103 . 1 102 THR N 1 102 THR CA 1 102 THR C 1 103 VAL N 137.40 -164.20 159.83 140.69 -154.04 10.16 6 3 "[ .+ - * . 2]"
104 . 1 103 VAL C 1 104 GLY N 1 104 GLY CA 1 104 GLY C 47.70 110.30 71.46 55.35 96.15 . . 0 "[ . 1 . 2]"
105 . 1 106 ALA N 1 106 ALA CA 1 106 ALA C 1 107 TRP N 119.30 -177.10 166.77 159.87 172.71 . . 0 "[ . 1 . 2]"
106 . 1 106 ALA C 1 107 TRP N 1 107 TRP CA 1 107 TRP C -166.70 -108.10 -157.31 -159.61 -161.77 1.59 9 0 "[ . 1 . 2]"
107 . 1 107 TRP N 1 107 TRP CA 1 107 TRP C 1 108 GLY N 111.70 151.70 147.14 139.55 151.38 . . 0 "[ . 1 . 2]"
108 . 1 108 GLY C 1 109 HIS N 1 109 HIS CA 1 109 HIS C -166.70 -117.50 -131.89 -135.64 -137.09 1.41 20 0 "[ . 1 . 2]"
109 . 1 109 HIS N 1 109 HIS CA 1 109 HIS C 1 110 PRO N 134.80 176.20 132.70 130.29 136.29 4.51 5 0 "[ . 1 . 2]"
110 . 1 109 HIS C 1 110 PRO N 1 110 PRO CA 1 110 PRO C -98.50 -44.70 -64.90 -89.76 -50.94 . . 0 "[ . 1 . 2]"
111 . 1 110 PRO N 1 110 PRO CA 1 110 PRO C 1 111 CYS N 121.20 168.00 146.59 118.36 117.09 4.20 15 0 "[ . 1 . 2]"
112 . 1 111 CYS C 1 112 GLU N 1 112 GLU CA 1 112 GLU C -160.50 -52.10 -99.45 -116.19 -50.29 1.81 8 0 "[ . 1 . 2]"
113 . 1 112 GLU N 1 112 GLU CA 1 112 GLU C 1 113 MET N 97.90 -176.30 110.91 95.64 123.00 2.26 13 0 "[ . 1 . 2]"
114 . 1 112 GLU C 1 113 MET N 1 113 MET CA 1 113 MET C -142.80 -47.20 -93.18 -80.29 -83.55 . . 0 "[ . 1 . 2]"
115 . 1 113 MET N 1 113 MET CA 1 113 MET C 1 114 CYS N 97.80 171.60 138.62 141.90 139.50 . . 0 "[ . 1 . 2]"
116 . 1 113 MET C 1 114 CYS N 1 114 CYS CA 1 114 CYS C -142.10 -40.30 -124.48 -128.08 -135.07 3.52 1 0 "[ . 1 . 2]"
117 . 1 114 CYS N 1 114 CYS CA 1 114 CYS C 1 115 PRO N 94.30 166.90 138.44 112.58 159.22 . . 0 "[ . 1 . 2]"
118 . 1 114 CYS C 1 115 PRO N 1 115 PRO CA 1 115 PRO C -80.70 -40.70 -64.43 -62.26 -63.27 0.71 17 0 "[ . 1 . 2]"
119 . 1 115 PRO N 1 115 PRO CA 1 115 PRO C 1 116 ALA N 124.80 164.80 163.09 167.04 166.91 8.61 19 2 "[ . 1 -. +2]"
120 . 1 118 PRO C 1 119 HIS N 1 119 HIS CA 1 119 HIS C -121.50 -49.50 -87.51 -135.76 -49.72 14.26 19 1 "[ . 1 . +2]"
121 . 1 119 HIS N 1 119 HIS CA 1 119 HIS C 1 120 PRO N 92.60 -175.80 152.81 158.13 156.09 5.66 14 1 "[ . 1 +. 2]"
122 . 1 121 CYS C 1 122 ARG N 1 122 ARG CA 1 122 ARG C -146.70 -28.70 -84.85 -92.75 -143.90 2.77 7 0 "[ . 1 . 2]"
123 . 1 122 ARG N 1 122 ARG CA 1 122 ARG C 1 123 ARG N 134.60 -148.20 140.63 131.68 149.53 2.92 2 0 "[ . 1 . 2]"
124 . 1 125 PHE C 1 126 ILE N 1 126 ILE CA 1 126 ILE C -153.20 -104.00 -127.37 -135.48 -121.79 . . 0 "[ . 1 . 2]"
125 . 1 126 ILE N 1 126 ILE CA 1 126 ILE C 1 127 PRO N 100.80 -172.00 130.10 121.34 141.74 . . 0 "[ . 1 . 2]"
126 . 1 126 ILE C 1 127 PRO N 1 127 PRO CA 1 127 PRO C -127.50 -19.90 -62.43 -58.42 -59.89 . . 0 "[ . 1 . 2]"
127 . 1 127 PRO N 1 127 PRO CA 1 127 PRO C 1 128 ASN N 112.90 167.30 117.46 115.27 113.82 1.31 5 0 "[ . 1 . 2]"
128 . 1 127 PRO C 1 128 ASN N 1 128 ASN CA 1 128 ASN C -144.10 -41.10 -52.99 -62.61 -47.13 . . 0 "[ . 1 . 2]"
129 . 1 128 ASN N 1 128 ASN CA 1 128 ASN C 1 129 ILE N 77.10 -178.30 134.09 132.21 131.03 . . 0 "[ . 1 . 2]"
130 . 1 134 CYS C 1 135 GLN N 1 135 GLN CA 1 135 GLN C -163.60 -74.00 -119.68 -126.85 -112.94 . . 0 "[ . 1 . 2]"
131 . 1 135 GLN N 1 135 GLN CA 1 135 GLN C 1 136 ASP N 119.90 174.30 137.47 131.24 143.51 . . 0 "[ . 1 . 2]"
132 . 1 135 GLN C 1 136 ASP N 1 136 ASP CA 1 136 ASP C -154.80 -34.60 -77.02 -77.18 -77.24 . . 0 "[ . 1 . 2]"
133 . 1 136 ASP N 1 136 ASP CA 1 136 ASP C 1 137 VAL N 106.50 164.10 146.32 149.68 148.08 . . 0 "[ . 1 . 2]"
134 . 1 136 ASP C 1 137 VAL N 1 137 VAL CA 1 137 VAL C -158.30 -58.50 -97.34 -100.79 -93.34 . . 0 "[ . 1 . 2]"
135 . 1 137 VAL N 1 137 VAL CA 1 137 VAL C 1 138 ASP N 90.00 171.80 146.27 142.88 151.65 . . 0 "[ . 1 . 2]"
136 . 1 137 VAL C 1 138 ASP N 1 138 ASP CA 1 138 ASP C -118.90 -64.30 -74.56 -72.58 -73.24 . . 0 "[ . 1 . 2]"
137 . 1 138 ASP N 1 138 ASP CA 1 138 ASP C 1 139 GLU N 77.70 132.90 77.37 75.89 81.07 1.81 2 0 "[ . 1 . 2]"
138 . 1 150 GLY C 1 151 ASN N 1 151 ASN CA 1 151 ASN C -164.10 -77.70 -100.60 -89.09 -94.84 . . 0 "[ . 1 . 2]"
139 . 1 151 ASN N 1 151 ASN CA 1 151 ASN C 1 152 CYS N 100.00 156.60 142.74 103.20 162.08 5.48 12 1 "[ . 1 + . 2]"
140 . 1 154 ASN C 1 155 THR N 1 155 THR CA 1 155 THR C -172.50 -50.50 -110.82 -107.21 -109.21 . . 0 "[ . 1 . 2]"
141 . 1 155 THR N 1 155 THR CA 1 155 THR C 1 156 VAL N 124.30 178.90 161.63 150.95 170.95 . . 0 "[ . 1 . 2]"
142 . 1 155 THR C 1 156 VAL N 1 156 VAL CA 1 156 VAL C -81.10 -34.30 -72.63 -72.39 -72.55 . . 0 "[ . 1 . 2]"
143 . 1 156 VAL N 1 156 VAL CA 1 156 VAL C 1 157 GLY N 112.40 152.40 126.94 119.52 133.33 . . 0 "[ . 1 . 2]"
144 . 1 156 VAL C 1 157 GLY N 1 157 GLY CA 1 157 GLY C 56.40 113.40 104.01 105.19 98.45 1.02 2 0 "[ . 1 . 2]"
145 . 1 157 GLY N 1 157 GLY CA 1 157 GLY C 1 158 SER N -36.90 28.50 -21.19 -33.38 -9.49 . . 0 "[ . 1 . 2]"
146 . 1 158 SER C 1 159 PHE N 1 159 PHE CA 1 159 PHE C 162.20 -60.60 -103.62 -114.09 -96.43 . . 0 "[ . 1 . 2]"
147 . 1 159 PHE N 1 159 PHE CA 1 159 PHE C 1 160 GLU N 118.20 -175.20 156.22 149.73 162.59 . . 0 "[ . 1 . 2]"
148 . 1 159 PHE C 1 160 GLU N 1 160 GLU CA 1 160 GLU C -168.10 -97.50 -112.66 -111.64 -113.18 . . 0 "[ . 1 . 2]"
149 . 1 160 GLU N 1 160 GLU CA 1 160 GLU C 1 161 CYS N 97.40 -169.40 126.73 118.20 117.59 . . 0 "[ . 1 . 2]"
150 . 1 161 CYS C 1 162 LYS N 1 162 LYS CA 1 162 LYS C -153.20 -61.40 -127.15 -155.05 -79.19 1.85 14 0 "[ . 1 . 2]"
151 . 1 162 LYS N 1 162 LYS CA 1 162 LYS C 1 163 CYS N 96.20 163.20 112.92 123.27 122.52 0.82 20 0 "[ . 1 . 2]"
152 . 1 162 LYS C 1 163 CYS N 1 163 CYS CA 1 163 CYS C -128.20 -53.60 -96.19 -99.45 -104.79 1.37 5 0 "[ . 1 . 2]"
153 . 1 163 CYS N 1 163 CYS CA 1 163 CYS C 1 164 PRO N 106.70 178.30 157.85 137.28 173.03 . . 0 "[ . 1 . 2]"
154 . 1 164 PRO C 1 165 ALA N 1 165 ALA CA 1 165 ALA C -88.20 -37.00 -56.23 -51.61 -53.10 . . 0 "[ . 1 . 2]"
155 . 1 165 ALA N 1 165 ALA CA 1 165 ALA C 1 166 GLY N 118.50 158.50 145.06 134.27 159.67 1.17 5 0 "[ . 1 . 2]"
156 . 1 166 GLY C 1 167 HIS N 1 167 HIS CA 1 167 HIS C -141.10 -36.70 -77.33 -74.20 -75.80 . . 0 "[ . 1 . 2]"
157 . 1 167 HIS N 1 167 HIS CA 1 167 HIS C 1 168 LYS N 71.00 -162.80 163.22 153.41 176.78 . . 0 "[ . 1 . 2]"
158 . 1 168 LYS C 1 169 LEU N 1 169 LEU CA 1 169 LEU C -138.40 -40.40 -78.87 -62.18 -63.13 . . 0 "[ . 1 . 2]"
159 . 1 169 LEU N 1 169 LEU CA 1 169 LEU C 1 170 ASN N 103.40 143.40 136.35 123.70 143.98 0.58 16 0 "[ . 1 . 2]"
160 . 1 171 GLU C 1 172 VAL N 1 172 VAL CA 1 172 VAL C -99.10 -57.10 -60.03 -61.27 -62.66 1.02 8 0 "[ . 1 . 2]"
161 . 1 172 VAL N 1 172 VAL CA 1 172 VAL C 1 173 SER N -58.80 -13.80 -34.86 -29.78 -31.77 0.22 5 0 "[ . 1 . 2]"
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