NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
546322 |
2lul   |
18526 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2lul
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 158
_TA_constraint_stats_list.Viol_count 441
_TA_constraint_stats_list.Viol_total 16430.16
_TA_constraint_stats_list.Viol_max 8.04
_TA_constraint_stats_list.Viol_rms 0.85
_TA_constraint_stats_list.Viol_average_all_restraints 0.26
_TA_constraint_stats_list.Viol_average_violations_only 1.86
_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 15 THR C 1 16 ILE N 1 16 ILE CA 1 16 ILE C -117.10 -64.40 -80.86 -74.58 -79.76 1.87 17 0 "[ . 1 . 2]"
2 . 1 16 ILE N 1 16 ILE CA 1 16 ILE C 1 17 LEU N -60.60 -14.60 -42.90 -42.47 -43.06 . . 0 "[ . 1 . 2]"
3 . 1 16 ILE C 1 17 LEU N 1 17 LEU CA 1 17 LEU C 177.30 -135.20 -166.01 -176.01 -152.90 . . 0 "[ . 1 . 2]"
4 . 1 17 LEU N 1 17 LEU CA 1 17 LEU C 1 18 GLU N 134.10 176.70 138.45 133.77 150.93 0.33 8 0 "[ . 1 . 2]"
5 . 1 17 LEU C 1 18 GLU N 1 18 GLU CA 1 18 GLU C -164.00 -95.70 -135.92 -125.36 -129.20 . . 0 "[ . 1 . 2]"
6 . 1 18 GLU N 1 18 GLU CA 1 18 GLU C 1 19 GLU N 107.30 149.50 142.18 149.25 147.65 . . 0 "[ . 1 . 2]"
7 . 1 18 GLU C 1 19 GLU N 1 19 GLU CA 1 19 GLU C -163.00 -98.80 -161.48 -165.31 -149.14 2.31 18 0 "[ . 1 . 2]"
8 . 1 19 GLU N 1 19 GLU CA 1 19 GLU C 1 20 ILE N 105.80 164.20 154.81 149.88 165.87 1.67 19 0 "[ . 1 . 2]"
9 . 1 19 GLU C 1 20 ILE N 1 20 ILE CA 1 20 ILE C -124.70 -76.20 -82.09 -79.81 -80.38 . . 0 "[ . 1 . 2]"
10 . 1 20 ILE N 1 20 ILE CA 1 20 ILE C 1 21 LEU N 95.40 146.30 96.30 91.74 104.77 3.66 2 0 "[ . 1 . 2]"
11 . 1 20 ILE C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -144.50 -79.70 -109.60 -105.00 -106.57 . . 0 "[ . 1 . 2]"
12 . 1 21 LEU N 1 21 LEU CA 1 21 LEU C 1 22 ILE N 124.60 179.80 156.57 145.51 -176.35 3.85 20 0 "[ . 1 . 2]"
13 . 1 21 LEU C 1 22 ILE N 1 22 ILE CA 1 22 ILE C -155.90 -99.40 -100.43 -102.16 -110.69 4.07 6 0 "[ . 1 . 2]"
14 . 1 22 ILE N 1 22 ILE CA 1 22 ILE C 1 23 LYS N 115.60 159.20 127.70 123.80 118.04 2.62 17 0 "[ . 1 . 2]"
15 . 1 22 ILE C 1 23 LYS N 1 23 LYS CA 1 23 LYS C -150.90 -86.30 -98.84 -143.60 -84.35 1.95 13 0 "[ . 1 . 2]"
16 . 1 23 LYS N 1 23 LYS CA 1 23 LYS C 1 24 ARG N 110.20 150.20 134.54 123.98 115.08 . . 0 "[ . 1 . 2]"
17 . 1 23 LYS C 1 24 ARG N 1 24 ARG CA 1 24 ARG C -153.40 -85.40 -85.76 -84.26 -85.04 2.44 19 0 "[ . 1 . 2]"
18 . 1 24 ARG N 1 24 ARG CA 1 24 ARG C 1 25 SER N 103.00 152.50 135.58 134.43 129.67 1.44 11 0 "[ . 1 . 2]"
19 . 1 24 ARG C 1 25 SER N 1 25 SER CA 1 25 SER C -127.20 -75.90 -87.09 -127.87 -73.19 2.71 4 0 "[ . 1 . 2]"
20 . 1 25 SER N 1 25 SER CA 1 25 SER C 1 26 GLN N 105.10 148.50 126.50 124.45 123.74 7.08 3 1 "[ + . 1 . 2]"
21 . 1 34 LEU C 1 35 ASN N 1 35 ASN CA 1 35 ASN C -166.60 -74.20 -85.13 -106.69 -72.48 1.72 8 0 "[ . 1 . 2]"
22 . 1 35 ASN N 1 35 ASN CA 1 35 ASN C 1 36 TYR N 130.60 179.40 137.53 160.56 147.83 4.62 13 0 "[ . 1 . 2]"
23 . 1 35 ASN C 1 36 TYR N 1 36 TYR CA 1 36 TYR C -147.90 -45.50 -106.52 -131.18 -87.55 . . 0 "[ . 1 . 2]"
24 . 1 36 TYR N 1 36 TYR CA 1 36 TYR C 1 37 LYS N 106.40 169.10 115.34 127.92 117.14 2.73 13 0 "[ . 1 . 2]"
25 . 1 36 TYR C 1 37 LYS N 1 37 LYS CA 1 37 LYS C -147.20 -107.20 -123.57 -148.92 -104.36 2.84 7 0 "[ . 1 . 2]"
26 . 1 37 LYS N 1 37 LYS CA 1 37 LYS C 1 38 GLU N 111.00 151.00 128.94 115.03 110.21 5.63 1 1 "[+ . 1 . 2]"
27 . 1 37 LYS C 1 38 GLU N 1 38 GLU CA 1 38 GLU C -133.30 -70.60 -90.44 -81.09 -84.11 1.49 14 0 "[ . 1 . 2]"
28 . 1 38 GLU N 1 38 GLU CA 1 38 GLU C 1 39 ARG N 107.90 147.90 119.56 116.00 110.73 4.52 3 0 "[ . 1 . 2]"
29 . 1 38 GLU C 1 39 ARG N 1 39 ARG CA 1 39 ARG C -156.00 -92.00 -139.34 -157.04 -121.90 1.04 5 0 "[ . 1 . 2]"
30 . 1 39 ARG N 1 39 ARG CA 1 39 ARG C 1 40 LEU N 109.80 175.10 165.10 146.91 179.36 4.26 12 0 "[ . 1 . 2]"
31 . 1 39 ARG C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -151.60 -61.90 -92.46 -104.96 -79.24 . . 0 "[ . 1 . 2]"
32 . 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 PHE N 93.70 139.60 106.44 92.83 130.96 0.87 17 0 "[ . 1 . 2]"
33 . 1 40 LEU C 1 41 PHE N 1 41 PHE CA 1 41 PHE C -137.00 -78.80 -91.09 -89.26 -95.16 1.18 16 0 "[ . 1 . 2]"
34 . 1 41 PHE N 1 41 PHE CA 1 41 PHE C 1 42 VAL N 116.20 156.20 122.87 114.07 142.10 2.13 16 0 "[ . 1 . 2]"
35 . 1 41 PHE C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -158.30 -90.30 -116.07 -113.85 -115.98 . . 0 "[ . 1 . 2]"
36 . 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 LEU N 101.10 164.30 121.31 115.21 133.27 . . 0 "[ . 1 . 2]"
37 . 1 42 VAL C 1 43 LEU N 1 43 LEU CA 1 43 LEU C -144.10 -103.60 -102.36 -104.29 -105.24 5.31 6 1 "[ .+ 1 . 2]"
38 . 1 43 LEU N 1 43 LEU CA 1 43 LEU C 1 44 THR N 108.90 148.90 115.69 104.42 129.73 4.48 20 0 "[ . 1 . 2]"
39 . 1 43 LEU C 1 44 THR N 1 44 THR CA 1 44 THR C -166.20 -83.20 -105.83 -109.57 -116.84 . . 0 "[ . 1 . 2]"
40 . 1 44 THR N 1 44 THR CA 1 44 THR C 1 45 LYS N 154.60 -158.50 171.64 164.01 -178.30 . . 0 "[ . 1 . 2]"
41 . 1 44 THR C 1 45 LYS N 1 45 LYS CA 1 45 LYS C -85.90 -45.90 -70.32 -78.60 -61.84 . . 0 "[ . 1 . 2]"
42 . 1 45 LYS N 1 45 LYS CA 1 45 LYS C 1 46 SER N -44.80 2.00 -9.99 -15.32 -18.34 2.89 9 0 "[ . 1 . 2]"
43 . 1 45 LYS C 1 46 SER N 1 46 SER CA 1 46 SER C -143.20 -68.70 -112.74 -140.57 -90.61 . . 0 "[ . 1 . 2]"
44 . 1 46 SER N 1 46 SER CA 1 46 SER C 1 47 MET N -35.80 40.90 -36.53 -41.46 -41.77 8.04 17 3 "[*- . 1 . + 2]"
45 . 1 46 SER C 1 47 MET N 1 47 MET CA 1 47 MET C -170.10 -79.20 -145.72 -150.57 -151.30 . . 0 "[ . 1 . 2]"
46 . 1 47 MET N 1 47 MET CA 1 47 MET C 1 48 LEU N 111.70 -179.60 148.03 128.29 175.75 . . 0 "[ . 1 . 2]"
47 . 1 47 MET C 1 48 LEU N 1 48 LEU CA 1 48 LEU C -139.00 -99.00 -100.59 -132.71 -94.63 4.37 3 0 "[ . 1 . 2]"
48 . 1 48 LEU N 1 48 LEU CA 1 48 LEU C 1 49 THR N 103.10 145.40 104.12 97.70 116.47 5.40 10 1 "[ . + . 2]"
49 . 1 48 LEU C 1 49 THR N 1 49 THR CA 1 49 THR C -162.80 -42.50 -112.80 -128.11 -130.93 . . 0 "[ . 1 . 2]"
50 . 1 49 THR N 1 49 THR CA 1 49 THR C 1 50 TYR N 93.90 174.60 135.68 141.23 133.10 . . 0 "[ . 1 . 2]"
51 . 1 49 THR C 1 50 TYR N 1 50 TYR CA 1 50 TYR C -171.20 -104.40 -114.98 -151.69 -101.37 3.03 14 0 "[ . 1 . 2]"
52 . 1 50 TYR N 1 50 TYR CA 1 50 TYR C 1 51 TYR N 131.30 -161.00 142.03 128.43 171.36 2.87 6 0 "[ . 1 . 2]"
53 . 1 50 TYR C 1 51 TYR N 1 51 TYR CA 1 51 TYR C -150.60 -110.60 -116.28 -109.37 -121.88 8.04 9 5 "[ . +* - * * 2]"
54 . 1 51 TYR N 1 51 TYR CA 1 51 TYR C 1 52 GLU N 121.10 172.90 137.50 142.74 139.68 3.40 8 0 "[ . 1 . 2]"
55 . 1 51 TYR C 1 52 GLU N 1 52 GLU CA 1 52 GLU C -150.10 -80.80 -120.34 -116.95 -133.36 1.58 9 0 "[ . 1 . 2]"
56 . 1 52 GLU N 1 52 GLU CA 1 52 GLU C 1 53 GLY N 82.30 154.20 146.54 134.66 94.63 4.89 5 0 "[ . 1 . 2]"
57 . 1 58 LYS C 1 59 TYR N 1 59 TYR CA 1 59 TYR C -135.80 -61.20 -91.40 -58.72 -62.61 2.48 2 0 "[ . 1 . 2]"
58 . 1 59 TYR N 1 59 TYR CA 1 59 TYR C 1 60 ARG N 93.20 -177.80 143.09 117.03 163.07 . . 0 "[ . 1 . 2]"
59 . 1 59 TYR C 1 60 ARG N 1 60 ARG CA 1 60 ARG C -139.20 -27.20 -73.67 -68.49 -71.20 . . 0 "[ . 1 . 2]"
60 . 1 60 ARG N 1 60 ARG CA 1 60 ARG C 1 61 LYS N 107.80 147.80 115.01 128.83 122.95 5.95 8 1 "[ . + 1 . 2]"
61 . 1 60 ARG C 1 61 LYS N 1 61 LYS CA 1 61 LYS C -166.90 -68.60 -112.61 -156.35 -78.55 . . 0 "[ . 1 . 2]"
62 . 1 61 LYS N 1 61 LYS CA 1 61 LYS C 1 62 GLY N 66.20 -153.80 130.53 125.43 94.10 4.25 8 0 "[ . 1 . 2]"
63 . 1 62 GLY C 1 63 PHE N 1 63 PHE CA 1 63 PHE C -159.00 -92.80 -147.53 -88.35 -157.62 6.20 14 2 "[ - . 1 +. 2]"
64 . 1 63 PHE N 1 63 PHE CA 1 63 PHE C 1 64 ILE N 123.50 174.00 155.26 140.99 174.22 0.22 11 0 "[ . 1 . 2]"
65 . 1 63 PHE C 1 64 ILE N 1 64 ILE CA 1 64 ILE C -167.80 -98.20 -124.43 -119.73 -121.33 . . 0 "[ . 1 . 2]"
66 . 1 64 ILE N 1 64 ILE CA 1 64 ILE C 1 65 ASP N 104.20 155.80 129.91 115.20 148.02 . . 0 "[ . 1 . 2]"
67 . 1 64 ILE C 1 65 ASP N 1 65 ASP CA 1 65 ASP C -97.80 -54.10 -77.36 -75.13 -76.66 0.25 14 0 "[ . 1 . 2]"
68 . 1 65 ASP N 1 65 ASP CA 1 65 ASP C 1 66 VAL N 87.50 144.40 135.17 123.53 146.57 2.17 14 0 "[ . 1 . 2]"
69 . 1 65 ASP C 1 66 VAL N 1 66 VAL CA 1 66 VAL C -78.00 -38.00 -63.00 -68.23 -57.66 . . 0 "[ . 1 . 2]"
70 . 1 66 VAL N 1 66 VAL CA 1 66 VAL C 1 67 SER N -70.10 -8.10 -32.14 -44.16 -22.84 . . 0 "[ . 1 . 2]"
71 . 1 66 VAL C 1 67 SER N 1 67 SER CA 1 67 SER C -88.30 -48.30 -71.45 -69.30 -71.00 . . 0 "[ . 1 . 2]"
72 . 1 67 SER N 1 67 SER CA 1 67 SER C 1 68 LYS N -55.10 9.60 -21.50 -44.68 -6.77 . . 0 "[ . 1 . 2]"
73 . 1 67 SER C 1 68 LYS N 1 68 LYS CA 1 68 LYS C -139.30 -56.20 -86.24 -103.79 -74.23 . . 0 "[ . 1 . 2]"
74 . 1 68 LYS N 1 68 LYS CA 1 68 LYS C 1 69 ILE N -50.20 57.20 -15.34 -24.88 -26.58 . . 0 "[ . 1 . 2]"
75 . 1 70 LYS C 1 71 CYS N 1 71 CYS CA 1 71 CYS C 145.10 -74.90 -164.11 -175.89 -134.39 . . 0 "[ . 1 . 2]"
76 . 1 71 CYS N 1 71 CYS CA 1 71 CYS C 1 72 VAL N 108.40 175.40 136.38 141.16 138.96 . . 0 "[ . 1 . 2]"
77 . 1 71 CYS C 1 72 VAL N 1 72 VAL CA 1 72 VAL C -157.20 -88.50 -130.59 -138.90 -104.75 . . 0 "[ . 1 . 2]"
78 . 1 72 VAL N 1 72 VAL CA 1 72 VAL C 1 73 GLU N 111.90 151.90 122.19 113.30 136.11 . . 0 "[ . 1 . 2]"
79 . 1 72 VAL C 1 73 GLU N 1 73 GLU CA 1 73 GLU C -159.10 -76.20 -153.97 -162.01 -142.68 2.91 4 0 "[ . 1 . 2]"
80 . 1 73 GLU N 1 73 GLU CA 1 73 GLU C 1 74 ILE N 116.70 169.40 165.13 156.84 171.38 1.98 14 0 "[ . 1 . 2]"
81 . 1 73 GLU C 1 74 ILE N 1 74 ILE CA 1 74 ILE C -102.70 -58.30 -68.77 -64.44 -65.97 0.88 17 0 "[ . 1 . 2]"
82 . 1 74 ILE N 1 74 ILE CA 1 74 ILE C 1 75 VAL N 122.40 162.40 160.50 156.93 156.42 3.11 5 0 "[ . 1 . 2]"
83 . 1 74 ILE C 1 75 VAL N 1 75 VAL CA 1 75 VAL C -178.70 -38.70 -102.86 -124.88 -90.49 . . 0 "[ . 1 . 2]"
84 . 1 75 VAL N 1 75 VAL CA 1 75 VAL C 1 76 LYS N 103.80 165.20 115.87 106.19 103.14 2.68 1 0 "[ . 1 . 2]"
85 . 1 75 VAL C 1 76 LYS N 1 76 LYS CA 1 76 LYS C -142.00 -43.60 -74.91 -66.95 -70.54 . . 0 "[ . 1 . 2]"
86 . 1 76 LYS N 1 76 LYS CA 1 76 LYS C 1 77 ASN N 99.90 150.60 102.19 98.43 98.08 4.01 17 0 "[ . 1 . 2]"
87 . 1 76 LYS C 1 77 ASN N 1 77 ASN CA 1 77 ASN C -140.70 -32.40 -81.01 -117.28 -56.60 . . 0 "[ . 1 . 2]"
88 . 1 77 ASN N 1 77 ASN CA 1 77 ASN C 1 78 ASP N 77.90 177.60 139.36 142.80 127.91 3.03 18 0 "[ . 1 . 2]"
89 . 1 89 PRO C 1 90 PHE N 1 90 PHE CA 1 90 PHE C -177.90 -67.40 -118.65 -135.81 -96.32 . . 0 "[ . 1 . 2]"
90 . 1 90 PHE N 1 90 PHE CA 1 90 PHE C 1 91 GLN N 135.70 -178.60 156.30 139.00 178.35 . . 0 "[ . 1 . 2]"
91 . 1 90 PHE C 1 91 GLN N 1 91 GLN CA 1 91 GLN C -160.20 -104.70 -118.36 -118.19 -124.13 3.61 13 0 "[ . 1 . 2]"
92 . 1 91 GLN N 1 91 GLN CA 1 91 GLN C 1 92 VAL N 133.60 173.60 145.76 144.63 142.18 . . 0 "[ . 1 . 2]"
93 . 1 91 GLN C 1 92 VAL N 1 92 VAL CA 1 92 VAL C -139.60 -88.70 -120.81 -126.68 -127.79 . . 0 "[ . 1 . 2]"
94 . 1 92 VAL N 1 92 VAL CA 1 92 VAL C 1 93 VAL N 102.50 142.50 100.50 96.96 107.70 5.54 14 1 "[ . 1 +. 2]"
95 . 1 92 VAL C 1 93 VAL N 1 93 VAL CA 1 93 VAL C -133.80 -71.50 -83.77 -74.14 -75.81 . . 0 "[ . 1 . 2]"
96 . 1 93 VAL N 1 93 VAL CA 1 93 VAL C 1 94 HIS N 100.50 144.30 114.15 96.61 135.26 3.89 2 0 "[ . 1 . 2]"
97 . 1 93 VAL C 1 94 HIS N 1 94 HIS CA 1 94 HIS C -150.00 -46.10 -123.96 -110.22 -126.19 0.68 9 0 "[ . 1 . 2]"
98 . 1 94 HIS N 1 94 HIS CA 1 94 HIS C 1 95 ASP N 133.10 -166.90 178.52 -173.18 -175.32 . . 0 "[ . 1 . 2]"
99 . 1 96 ALA C 1 97 ASN N 1 97 ASN CA 1 97 ASN C 162.40 -66.00 -143.10 -149.33 -152.05 3.31 9 0 "[ . 1 . 2]"
100 . 1 97 ASN N 1 97 ASN CA 1 97 ASN C 1 98 THR N 118.30 -170.00 173.32 -178.09 178.61 0.10 15 0 "[ . 1 . 2]"
101 . 1 97 ASN C 1 98 THR N 1 98 THR CA 1 98 THR C -138.40 -72.90 -89.82 -85.55 -89.55 2.14 10 0 "[ . 1 . 2]"
102 . 1 98 THR N 1 98 THR CA 1 98 THR C 1 99 LEU N 98.70 147.30 117.89 112.14 109.10 1.76 11 0 "[ . 1 . 2]"
103 . 1 98 THR C 1 99 LEU N 1 99 LEU CA 1 99 LEU C -141.10 -84.80 -91.49 -122.76 -81.67 3.13 5 0 "[ . 1 . 2]"
104 . 1 99 LEU N 1 99 LEU CA 1 99 LEU C 1 100 TYR N 97.50 150.20 142.19 114.06 152.08 1.88 11 0 "[ . 1 . 2]"
105 . 1 99 LEU C 1 100 TYR N 1 100 TYR CA 1 100 TYR C -135.50 -76.50 -118.82 -123.62 -124.85 . . 0 "[ . 1 . 2]"
106 . 1 100 TYR N 1 100 TYR CA 1 100 TYR C 1 101 ILE N 105.80 159.20 114.79 103.09 131.58 2.71 10 0 "[ . 1 . 2]"
107 . 1 100 TYR C 1 101 ILE N 1 101 ILE CA 1 101 ILE C -154.40 -89.00 -116.49 -120.16 -122.38 . . 0 "[ . 1 . 2]"
108 . 1 101 ILE N 1 101 ILE CA 1 101 ILE C 1 102 PHE N 113.20 170.40 124.77 129.36 117.60 1.65 8 0 "[ . 1 . 2]"
109 . 1 101 ILE C 1 102 PHE N 1 102 PHE CA 1 102 PHE C -158.00 -38.00 -96.05 -130.78 -79.25 . . 0 "[ . 1 . 2]"
110 . 1 102 PHE N 1 102 PHE CA 1 102 PHE C 1 103 ALA N 105.60 154.60 124.19 130.09 128.26 . . 0 "[ . 1 . 2]"
111 . 1 102 PHE C 1 103 ALA N 1 103 ALA CA 1 103 ALA C -144.80 -35.10 -92.19 -90.58 -91.17 . . 0 "[ . 1 . 2]"
112 . 1 103 ALA N 1 103 ALA CA 1 103 ALA C 1 104 PRO N 77.70 -170.40 144.05 149.05 146.96 . . 0 "[ . 1 . 2]"
113 . 1 106 PRO C 1 107 GLN N 1 107 GLN CA 1 107 GLN C -84.00 -44.00 -81.65 -87.19 -73.36 3.19 5 0 "[ . 1 . 2]"
114 . 1 107 GLN N 1 107 GLN CA 1 107 GLN C 1 108 SER N -60.20 -20.20 -44.19 -32.94 -36.66 . . 0 "[ . 1 . 2]"
115 . 1 107 GLN C 1 108 SER N 1 108 SER CA 1 108 SER C -85.40 -45.40 -62.37 -68.06 -57.08 . . 0 "[ . 1 . 2]"
116 . 1 108 SER N 1 108 SER CA 1 108 SER C 1 109 ARG N -65.10 -25.10 -46.28 -50.83 -53.63 . . 0 "[ . 1 . 2]"
117 . 1 108 SER C 1 109 ARG N 1 109 ARG CA 1 109 ARG C -83.30 -43.30 -52.86 -65.17 -42.77 0.53 15 0 "[ . 1 . 2]"
118 . 1 109 ARG N 1 109 ARG CA 1 109 ARG C 1 110 ASP N -64.00 -24.00 -49.09 -65.34 -35.84 1.34 11 0 "[ . 1 . 2]"
119 . 1 109 ARG C 1 110 ASP N 1 110 ASP CA 1 110 ASP C -84.40 -44.40 -62.41 -73.72 -54.68 . . 0 "[ . 1 . 2]"
120 . 1 110 ASP N 1 110 ASP CA 1 110 ASP C 1 111 LEU N -59.80 -19.80 -42.83 -44.71 -48.67 . . 0 "[ . 1 . 2]"
121 . 1 110 ASP C 1 111 LEU N 1 111 LEU CA 1 111 LEU C -87.50 -47.50 -69.39 -68.98 -69.47 . . 0 "[ . 1 . 2]"
122 . 1 111 LEU N 1 111 LEU CA 1 111 LEU C 1 112 TRP N -61.60 -21.60 -43.84 -52.47 -35.85 . . 0 "[ . 1 . 2]"
123 . 1 111 LEU C 1 112 TRP N 1 112 TRP CA 1 112 TRP C -84.60 -44.60 -62.78 -63.25 -63.86 . . 0 "[ . 1 . 2]"
124 . 1 112 TRP N 1 112 TRP CA 1 112 TRP C 1 113 VAL N -65.30 -25.30 -49.60 -49.17 -50.36 . . 0 "[ . 1 . 2]"
125 . 1 112 TRP C 1 113 VAL N 1 113 VAL CA 1 113 VAL C -81.50 -41.50 -58.95 -65.90 -52.67 . . 0 "[ . 1 . 2]"
126 . 1 113 VAL N 1 113 VAL CA 1 113 VAL C 1 114 LYS N -64.00 -24.00 -43.45 -45.92 -47.46 . . 0 "[ . 1 . 2]"
127 . 1 113 VAL C 1 114 LYS N 1 114 LYS CA 1 114 LYS C -79.30 -39.30 -59.78 -65.37 -54.47 . . 0 "[ . 1 . 2]"
128 . 1 114 LYS N 1 114 LYS CA 1 114 LYS C 1 115 LYS N -64.20 -24.20 -54.71 -56.72 -57.98 . . 0 "[ . 1 . 2]"
129 . 1 114 LYS C 1 115 LYS N 1 115 LYS CA 1 115 LYS C -83.10 -43.10 -58.95 -61.21 -63.70 . . 0 "[ . 1 . 2]"
130 . 1 115 LYS N 1 115 LYS CA 1 115 LYS C 1 116 LEU N -54.00 -14.00 -44.65 -54.26 -24.92 0.26 7 0 "[ . 1 . 2]"
131 . 1 115 LYS C 1 116 LEU N 1 116 LEU CA 1 116 LEU C -80.90 -40.90 -64.11 -62.16 -62.97 0.84 11 0 "[ . 1 . 2]"
132 . 1 116 LEU N 1 116 LEU CA 1 116 LEU C 1 117 LYS N -61.90 -21.90 -51.74 -60.48 -43.40 . . 0 "[ . 1 . 2]"
133 . 1 116 LEU C 1 117 LYS N 1 117 LYS CA 1 117 LYS C -78.40 -38.40 -59.48 -69.18 -52.14 . . 0 "[ . 1 . 2]"
134 . 1 117 LYS N 1 117 LYS CA 1 117 LYS C 1 118 GLU N -68.40 -28.40 -38.45 -40.16 -42.23 1.22 18 0 "[ . 1 . 2]"
135 . 1 117 LYS C 1 118 GLU N 1 118 GLU CA 1 118 GLU C -82.70 -42.70 -68.85 -83.80 -57.51 1.10 2 0 "[ . 1 . 2]"
136 . 1 118 GLU N 1 118 GLU CA 1 118 GLU C 1 119 GLU N -56.60 -16.60 -24.49 -18.29 -20.99 1.57 2 0 "[ . 1 . 2]"
137 . 1 118 GLU C 1 119 GLU N 1 119 GLU CA 1 119 GLU C -87.20 -42.80 -81.67 -85.84 -87.80 1.54 1 0 "[ . 1 . 2]"
138 . 1 119 GLU N 1 119 GLU CA 1 119 GLU C 1 120 ILE N -52.20 -0.90 -45.63 -45.56 -46.99 1.59 9 0 "[ . 1 . 2]"
139 . 1 119 GLU C 1 120 ILE N 1 120 ILE CA 1 120 ILE C -136.90 -38.10 -81.28 -96.05 -71.69 . . 0 "[ . 1 . 2]"
140 . 1 120 ILE N 1 120 ILE CA 1 120 ILE C 1 121 LYS N -55.00 19.10 -6.87 -14.03 7.63 . . 0 "[ . 1 . 2]"
141 . 1 120 ILE C 1 121 LYS N 1 121 LYS CA 1 121 LYS C -107.70 -26.70 -68.57 -78.46 -61.57 . . 0 "[ . 1 . 2]"
142 . 1 121 LYS N 1 121 LYS CA 1 121 LYS C 1 122 ASN N -58.70 -13.60 -19.29 -24.17 -24.58 2.70 12 0 "[ . 1 . 2]"
143 . 1 121 LYS C 1 122 ASN N 1 122 ASN CA 1 122 ASN C -120.60 -64.10 -84.70 -80.94 -84.76 . . 0 "[ . 1 . 2]"
144 . 1 122 ASN N 1 122 ASN CA 1 122 ASN C 1 123 ASN N -34.60 21.30 -7.45 -23.54 6.33 . . 0 "[ . 1 . 2]"
145 . 1 128 ILE C 1 129 LYS N 1 129 LYS CA 1 129 LYS C -165.80 -86.10 -127.38 -135.69 -119.22 . . 0 "[ . 1 . 2]"
146 . 1 129 LYS N 1 129 LYS CA 1 129 LYS C 1 130 TYR N 131.00 171.00 157.14 162.12 159.28 0.35 5 0 "[ . 1 . 2]"
147 . 1 129 LYS C 1 130 TYR N 1 130 TYR CA 1 130 TYR C -155.60 -94.70 -141.80 -156.24 -129.80 0.64 20 0 "[ . 1 . 2]"
148 . 1 130 TYR N 1 130 TYR CA 1 130 TYR C 1 131 HIS N 110.80 172.70 174.54 173.80 173.43 5.62 4 1 "[ +. 1 . 2]"
149 . 1 130 TYR C 1 131 HIS N 1 131 HIS CA 1 131 HIS C -177.90 -61.10 -104.36 -102.50 -103.00 . . 0 "[ . 1 . 2]"
150 . 1 131 HIS N 1 131 HIS CA 1 131 HIS C 1 132 PRO N 67.80 169.00 115.12 95.10 130.27 . . 0 "[ . 1 . 2]"
151 . 1 153 CYS C 1 154 GLU N 1 154 GLU CA 1 154 GLU C -152.90 -96.20 -104.34 -120.82 -95.24 0.96 4 0 "[ . 1 . 2]"
152 . 1 154 GLU N 1 154 GLU CA 1 154 GLU C 1 155 LYS N 111.20 169.00 147.00 132.77 166.40 . . 0 "[ . 1 . 2]"
153 . 1 154 GLU C 1 155 LYS N 1 155 LYS CA 1 155 LYS C -106.50 -64.60 -69.19 -70.12 -74.11 2.92 5 0 "[ . 1 . 2]"
154 . 1 155 LYS N 1 155 LYS CA 1 155 LYS C 1 156 TYR N 100.80 154.60 133.63 139.63 137.39 . . 0 "[ . 1 . 2]"
155 . 1 155 LYS C 1 156 TYR N 1 156 TYR CA 1 156 TYR C -129.20 -75.60 -101.00 -125.55 -82.03 . . 0 "[ . 1 . 2]"
156 . 1 156 TYR N 1 156 TYR CA 1 156 TYR C 1 157 ASN N 82.20 157.00 122.14 105.05 144.63 . . 0 "[ . 1 . 2]"
157 . 1 156 TYR C 1 157 ASN N 1 157 ASN CA 1 157 ASN C -136.80 -58.00 -96.70 -119.76 -80.16 . . 0 "[ . 1 . 2]"
158 . 1 157 ASN N 1 157 ASN CA 1 157 ASN C 1 158 LEU N 45.70 -174.30 99.61 96.50 94.71 . . 0 "[ . 1 . 2]"
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