NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
550303 |
2lsn   |
17745 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2lsn
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 225
_TA_constraint_stats_list.Viol_count 153
_TA_constraint_stats_list.Viol_total 1255.40
_TA_constraint_stats_list.Viol_max 2.41
_TA_constraint_stats_list.Viol_rms 0.11
_TA_constraint_stats_list.Viol_average_all_restraints 0.02
_TA_constraint_stats_list.Viol_average_violations_only 0.43
_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 2 ALA C 1 3 MET N 1 3 MET CA 1 3 MET C -126.72 -62.76 -64.38 -62.95 -63.92 0.16 18 0 "[ . 1 . ]"
2 . 1 7 GLU C 1 8 GLY N 1 8 GLY CA 1 8 GLY C -178.33 -130.33 -175.40 -179.60 -159.88 1.27 13 0 "[ . 1 . ]"
3 . 1 8 GLY C 1 9 VAL N 1 9 VAL CA 1 9 VAL C -153.04 -89.04 -131.87 -142.55 -123.00 . . 0 "[ . 1 . ]"
4 . 1 9 VAL C 1 10 PHE N 1 10 PHE CA 1 10 PHE C -148.33 -98.77 -117.34 -117.89 -118.21 . . 0 "[ . 1 . ]"
5 . 1 11 TYR C 1 12 THR N 1 12 THR CA 1 12 THR C -166.92 -97.16 -116.66 -121.70 -106.45 . . 0 "[ . 1 . ]"
6 . 1 12 THR C 1 13 ASP N 1 13 ASP CA 1 13 ASP C -170.30 -114.66 -145.67 -140.62 -142.22 . . 0 "[ . 1 . ]"
7 . 1 14 GLY C 1 15 SER N 1 15 SER CA 1 15 SER C -143.40 -79.12 -133.97 -133.49 -138.69 0.13 6 0 "[ . 1 . ]"
8 . 1 15 SER C 1 16 ALA N 1 16 ALA CA 1 16 ALA C -176.20 -72.64 -133.24 -142.99 -145.35 . . 0 "[ . 1 . ]"
9 . 1 16 ALA C 1 17 ILE N 1 17 ILE CA 1 17 ILE C 179.41 -62.71 -119.28 -123.70 -126.54 . . 0 "[ . 1 . ]"
10 . 1 18 LYS C 1 19 SER N 1 19 SER CA 1 19 SER C -125.53 -40.53 -117.34 -121.39 -124.27 1.02 19 0 "[ . 1 . ]"
11 . 1 22 PRO C 1 23 THR N 1 23 THR CA 1 23 THR C -140.61 -54.85 -56.11 -60.16 -52.44 2.41 19 0 "[ . 1 . ]"
12 . 1 26 ASN C 1 27 ASN N 1 27 ASN CA 1 27 ASN C -164.66 -83.34 -95.54 -105.31 -83.31 0.03 9 0 "[ . 1 . ]"
13 . 1 27 ASN C 1 28 ALA N 1 28 ALA CA 1 28 ALA C -173.02 -93.02 -122.43 -145.71 -93.17 . . 0 "[ . 1 . ]"
14 . 1 28 ALA C 1 29 GLY N 1 29 GLY CA 1 29 GLY C 164.48 -88.16 -144.95 -141.25 -141.67 . . 0 "[ . 1 . ]"
15 . 1 29 GLY C 1 30 MET N 1 30 MET CA 1 30 MET C 176.88 -103.12 -124.10 -133.46 -113.99 . . 0 "[ . 1 . ]"
16 . 1 30 MET C 1 31 GLY N 1 31 GLY CA 1 31 GLY C -168.21 -88.21 -145.82 -156.82 -126.19 . . 0 "[ . 1 . ]"
17 . 1 31 GLY C 1 32 ILE N 1 32 ILE CA 1 32 ILE C -171.29 -91.29 -117.32 -111.13 -112.97 . . 0 "[ . 1 . ]"
18 . 1 32 ILE C 1 33 VAL N 1 33 VAL CA 1 33 VAL C -159.07 -79.07 -123.04 -136.64 -114.73 . . 0 "[ . 1 . ]"
19 . 1 33 VAL C 1 34 HIS N 1 34 HIS CA 1 34 HIS C -161.79 -81.79 -106.44 -116.05 -101.01 . . 0 "[ . 1 . ]"
20 . 1 34 HIS C 1 35 ALA N 1 35 ALA CA 1 35 ALA C -168.55 -88.55 -132.85 -143.10 -119.52 . . 0 "[ . 1 . ]"
21 . 1 35 ALA C 1 36 THR N 1 36 THR CA 1 36 THR C 174.98 -105.02 -128.65 -127.75 -129.90 . . 0 "[ . 1 . ]"
22 . 1 37 TYR C 1 38 LYS N 1 38 LYS CA 1 38 LYS C -148.94 -51.58 -51.27 -51.39 -51.46 0.76 16 0 "[ . 1 . ]"
23 . 1 39 PRO C 1 40 GLU N 1 40 GLU CA 1 40 GLU C -166.51 -70.11 -131.99 -128.11 -129.25 . . 0 "[ . 1 . ]"
24 . 1 40 GLU C 1 41 TYR N 1 41 TYR CA 1 41 TYR C -128.35 -48.35 -63.74 -74.01 -54.44 . . 0 "[ . 1 . ]"
25 . 1 41 TYR C 1 42 GLN N 1 42 GLN CA 1 42 GLN C -167.91 -87.91 -160.79 -168.21 -151.90 0.30 2 0 "[ . 1 . ]"
26 . 1 42 GLN C 1 43 VAL N 1 43 VAL CA 1 43 VAL C -128.18 -48.18 -74.97 -64.96 -71.47 0.24 7 0 "[ . 1 . ]"
27 . 1 43 VAL C 1 44 LEU N 1 44 LEU CA 1 44 LEU C -129.80 -49.80 -63.97 -64.27 -65.01 . . 0 "[ . 1 . ]"
28 . 1 44 LEU C 1 45 ASN N 1 45 ASN CA 1 45 ASN C 176.29 -103.71 -169.33 -162.71 -168.76 . . 0 "[ . 1 . ]"
29 . 1 45 ASN C 1 46 GLN N 1 46 GLN CA 1 46 GLN C 173.00 -107.00 -111.80 -121.70 -106.85 0.15 8 0 "[ . 1 . ]"
30 . 1 46 GLN C 1 47 TRP N 1 47 TRP CA 1 47 TRP C -175.96 -95.96 -127.46 -132.16 -133.31 . . 0 "[ . 1 . ]"
31 . 1 47 TRP C 1 48 SER N 1 48 SER CA 1 48 SER C -145.20 -65.20 -126.26 -132.83 -119.85 . . 0 "[ . 1 . ]"
32 . 1 48 SER C 1 49 ILE N 1 49 ILE CA 1 49 ILE C -166.52 -71.36 -136.54 -127.17 -129.43 . . 0 "[ . 1 . ]"
33 . 1 49 ILE C 1 50 PRO N 1 50 PRO CA 1 50 PRO C -133.75 -52.79 -70.47 -70.02 -70.39 . . 0 "[ . 1 . ]"
34 . 1 50 PRO C 1 51 LEU N 1 51 LEU CA 1 51 LEU C -159.77 -70.85 -109.00 -123.88 -99.73 . . 0 "[ . 1 . ]"
35 . 1 53 ASN C 1 54 HIS N 1 54 HIS CA 1 54 HIS C -165.83 -85.83 -123.77 -129.11 -129.47 . . 0 "[ . 1 . ]"
36 . 1 54 HIS C 1 55 THR N 1 55 THR CA 1 55 THR C -128.18 -48.18 -111.76 -128.93 -87.43 0.75 18 0 "[ . 1 . ]"
37 . 1 55 THR C 1 56 ALA N 1 56 ALA CA 1 56 ALA C -101.24 -21.24 -54.79 -56.98 -57.29 . . 0 "[ . 1 . ]"
38 . 1 56 ALA C 1 57 GLN N 1 57 GLN CA 1 57 GLN C -101.10 -21.10 -65.48 -79.49 -54.38 . . 0 "[ . 1 . ]"
39 . 1 57 GLN C 1 58 MET N 1 58 MET CA 1 58 MET C -102.23 -22.23 -52.77 -55.15 -61.63 . . 0 "[ . 1 . ]"
40 . 1 58 MET C 1 59 ALA N 1 59 ALA CA 1 59 ALA C -103.92 -23.92 -73.94 -82.44 -64.11 . . 0 "[ . 1 . ]"
41 . 1 59 ALA C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -103.99 -23.99 -67.62 -67.91 -70.34 . . 0 "[ . 1 . ]"
42 . 1 60 GLU C 1 61 ILE N 1 61 ILE CA 1 61 ILE C -106.68 -26.68 -73.38 -86.92 -63.12 . . 0 "[ . 1 . ]"
43 . 1 61 ILE C 1 62 ALA N 1 62 ALA CA 1 62 ALA C -105.53 -25.53 -68.57 -64.90 -65.80 . . 0 "[ . 1 . ]"
44 . 1 62 ALA C 1 63 ALA N 1 63 ALA CA 1 63 ALA C -104.30 -24.30 -62.99 -60.46 -64.17 . . 0 "[ . 1 . ]"
45 . 1 63 ALA C 1 64 VAL N 1 64 VAL CA 1 64 VAL C -102.77 -22.77 -72.05 -79.29 -63.13 . . 0 "[ . 1 . ]"
46 . 1 64 VAL C 1 65 GLU N 1 65 GLU CA 1 65 GLU C -102.56 -22.56 -62.58 -60.28 -64.30 . . 0 "[ . 1 . ]"
47 . 1 65 GLU C 1 66 PHE N 1 66 PHE CA 1 66 PHE C -100.50 -20.50 -57.78 -63.26 -52.37 . . 0 "[ . 1 . ]"
48 . 1 66 PHE C 1 67 ALA N 1 67 ALA CA 1 67 ALA C -103.90 -23.90 -60.68 -64.19 -54.66 . . 0 "[ . 1 . ]"
49 . 1 67 ALA C 1 68 CYS N 1 68 CYS CA 1 68 CYS C -97.71 -17.71 -60.77 -75.51 -42.47 . . 0 "[ . 1 . ]"
50 . 1 68 CYS C 1 69 LYS N 1 69 LYS CA 1 69 LYS C -102.84 -22.84 -61.23 -59.27 -59.76 . . 0 "[ . 1 . ]"
51 . 1 69 LYS C 1 70 LYS N 1 70 LYS CA 1 70 LYS C -105.81 -25.81 -62.21 -61.15 -62.62 . . 0 "[ . 1 . ]"
52 . 1 70 LYS C 1 71 ALA N 1 71 ALA CA 1 71 ALA C -103.31 -23.31 -60.69 -55.74 -56.75 . . 0 "[ . 1 . ]"
53 . 1 71 ALA C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -104.54 -24.54 -52.35 -50.18 -51.23 . . 0 "[ . 1 . ]"
54 . 1 73 LYS C 1 74 ILE N 1 74 ILE CA 1 74 ILE C -135.74 -48.42 -51.23 -61.66 -48.20 0.22 11 0 "[ . 1 . ]"
55 . 1 76 GLY C 1 77 PRO N 1 77 PRO CA 1 77 PRO C -114.25 -25.45 -68.96 -69.80 -69.97 . . 0 "[ . 1 . ]"
56 . 1 77 PRO C 1 78 VAL N 1 78 VAL CA 1 78 VAL C -175.12 -47.88 -119.32 -116.24 -120.00 . . 0 "[ . 1 . ]"
57 . 1 78 VAL C 1 79 LEU N 1 79 LEU CA 1 79 LEU C -147.22 -67.22 -103.96 -105.92 -107.83 . . 0 "[ . 1 . ]"
58 . 1 79 LEU C 1 80 VAL N 1 80 VAL CA 1 80 VAL C -153.32 -73.32 -115.09 -130.35 -101.44 . . 0 "[ . 1 . ]"
59 . 1 80 VAL C 1 81 ILE N 1 81 ILE CA 1 81 ILE C -150.07 -70.07 -114.89 -107.99 -111.08 . . 0 "[ . 1 . ]"
60 . 1 81 ILE C 1 82 THR N 1 82 THR CA 1 82 THR C -147.10 -67.10 -133.88 -143.48 -124.85 . . 0 "[ . 1 . ]"
61 . 1 83 ASP C 1 84 SER N 1 84 SER CA 1 84 SER C -142.21 -41.13 -116.26 -137.96 -64.69 . . 0 "[ . 1 . ]"
62 . 1 84 SER C 1 85 PHE N 1 85 PHE CA 1 85 PHE C -95.13 -15.13 -75.76 -81.40 -64.16 . . 0 "[ . 1 . ]"
63 . 1 85 PHE C 1 86 TYR N 1 86 TYR CA 1 86 TYR C -99.46 -19.46 -57.96 -78.98 -47.16 . . 0 "[ . 1 . ]"
64 . 1 86 TYR C 1 87 VAL N 1 87 VAL CA 1 87 VAL C -102.72 -22.72 -62.11 -70.18 -55.88 . . 0 "[ . 1 . ]"
65 . 1 87 VAL C 1 88 ALA N 1 88 ALA CA 1 88 ALA C -100.76 -20.76 -53.68 -50.77 -52.88 . . 0 "[ . 1 . ]"
66 . 1 89 GLU C 1 90 SER N 1 90 SER CA 1 90 SER C -106.49 -26.49 -55.69 -57.30 -59.88 . . 0 "[ . 1 . ]"
67 . 1 90 SER C 1 91 ALA N 1 91 ALA CA 1 91 ALA C -103.91 -23.91 -86.00 -96.43 -66.47 . . 0 "[ . 1 . ]"
68 . 1 91 ALA C 1 92 ASN N 1 92 ASN CA 1 92 ASN C -120.21 -40.21 -87.05 -84.66 -85.61 . . 0 "[ . 1 . ]"
69 . 1 92 ASN C 1 93 LYS N 1 93 LYS CA 1 93 LYS C -126.31 -46.31 -126.12 -127.52 -116.64 1.21 14 0 "[ . 1 . ]"
70 . 1 94 GLU C 1 95 LEU N 1 95 LEU CA 1 95 LEU C -96.55 -16.55 -56.66 -64.86 -50.68 . . 0 "[ . 1 . ]"
71 . 1 95 LEU C 1 96 PRO N 1 96 PRO CA 1 96 PRO C -98.96 -18.96 -67.22 -68.69 -70.17 . . 0 "[ . 1 . ]"
72 . 1 96 PRO C 1 97 TYR N 1 97 TYR CA 1 97 TYR C -106.83 -26.83 -69.24 -75.56 -63.31 . . 0 "[ . 1 . ]"
73 . 1 97 TYR C 1 98 TRP N 1 98 TRP CA 1 98 TRP C -101.72 -21.72 -63.90 -63.46 -63.80 . . 0 "[ . 1 . ]"
74 . 1 98 TRP C 1 99 LYS N 1 99 LYS CA 1 99 LYS C -108.52 -28.52 -46.65 -52.08 -54.31 . . 0 "[ . 1 . ]"
75 . 1 99 LYS C 1 100 SER N 1 100 SER CA 1 100 SER C -112.35 -32.35 -61.96 -73.57 -53.25 . . 0 "[ . 1 . ]"
76 . 1 100 SER C 1 101 ASN N 1 101 ASN CA 1 101 ASN C -134.22 -54.22 -85.59 -87.85 -90.28 . . 0 "[ . 1 . ]"
77 . 1 102 GLY C 1 103 PHE N 1 103 PHE CA 1 103 PHE C 20.41 100.41 62.49 40.75 68.21 . . 0 "[ . 1 . ]"
78 . 1 106 ASN C 1 107 LYS N 1 107 LYS CA 1 107 LYS C -106.70 -26.70 -65.20 -77.54 -53.12 . . 0 "[ . 1 . ]"
79 . 1 113 HIS C 1 114 ILE N 1 114 ILE CA 1 114 ILE C -97.73 -17.73 -62.30 -62.50 -62.88 . . 0 "[ . 1 . ]"
80 . 1 114 ILE C 1 115 SER N 1 115 SER CA 1 115 SER C -98.71 -18.71 -55.93 -62.12 -47.39 . . 0 "[ . 1 . ]"
81 . 1 115 SER C 1 116 LYS N 1 116 LYS CA 1 116 LYS C -99.62 -19.62 -60.45 -55.73 -58.49 . . 0 "[ . 1 . ]"
82 . 1 116 LYS C 1 117 TRP N 1 117 TRP CA 1 117 TRP C -100.50 -20.50 -68.61 -62.17 -65.03 . . 0 "[ . 1 . ]"
83 . 1 117 TRP C 1 118 LYS N 1 118 LYS CA 1 118 LYS C -101.61 -21.61 -56.83 -56.88 -57.38 . . 0 "[ . 1 . ]"
84 . 1 118 LYS C 1 119 SER N 1 119 SER CA 1 119 SER C -106.33 -26.33 -59.05 -58.58 -59.96 . . 0 "[ . 1 . ]"
85 . 1 119 SER C 1 120 ILE N 1 120 ILE CA 1 120 ILE C -103.29 -23.29 -69.91 -67.95 -68.79 . . 0 "[ . 1 . ]"
86 . 1 120 ILE C 1 121 ALA N 1 121 ALA CA 1 121 ALA C -102.29 -22.29 -62.02 -59.56 -60.91 . . 0 "[ . 1 . ]"
87 . 1 121 ALA C 1 122 GLU N 1 122 GLU CA 1 122 GLU C -108.51 -28.51 -58.16 -62.44 -64.76 . . 0 "[ . 1 . ]"
88 . 1 122 GLU C 1 123 CYS N 1 123 CYS CA 1 123 CYS C -104.34 -24.34 -74.21 -68.58 -76.60 . . 0 "[ . 1 . ]"
89 . 1 123 CYS C 1 124 LEU N 1 124 LEU CA 1 124 LEU C -96.64 -16.64 -62.51 -71.09 -57.78 . . 0 "[ . 1 . ]"
90 . 1 124 LEU C 1 125 SER N 1 125 SER CA 1 125 SER C -103.64 -23.64 -60.83 -63.33 -66.12 . . 0 "[ . 1 . ]"
91 . 1 125 SER C 1 126 MET N 1 126 MET CA 1 126 MET C -126.46 -46.46 -65.98 -68.56 -71.25 . . 0 "[ . 1 . ]"
92 . 1 129 ASP C 1 130 ILE N 1 130 ILE CA 1 130 ILE C -126.57 -40.57 -65.26 -59.30 -61.77 . . 0 "[ . 1 . ]"
93 . 1 130 ILE C 1 131 THR N 1 131 THR CA 1 131 THR C -160.78 -80.78 -110.52 -119.28 -94.03 . . 0 "[ . 1 . ]"
94 . 1 131 THR C 1 132 ILE N 1 132 ILE CA 1 132 ILE C -148.78 -68.78 -121.77 -127.01 -110.47 . . 0 "[ . 1 . ]"
95 . 1 132 ILE C 1 133 GLN N 1 133 GLN CA 1 133 GLN C -161.25 -81.25 -126.58 -128.58 -132.58 . . 0 "[ . 1 . ]"
96 . 1 133 GLN C 1 134 HIS N 1 134 HIS CA 1 134 HIS C -158.62 -78.62 -110.77 -112.03 -112.81 . . 0 "[ . 1 . ]"
97 . 1 134 HIS C 1 135 GLU N 1 135 GLU CA 1 135 GLU C -172.62 -53.22 -99.37 -137.64 -58.05 . . 0 "[ . 1 . ]"
98 . 1 144 SER C 1 145 ILE N 1 145 ILE CA 1 145 ILE C -111.48 -31.48 -62.78 -71.18 -77.49 . . 0 "[ . 1 . ]"
99 . 1 145 ILE C 1 146 HIS N 1 146 HIS CA 1 146 HIS C -149.74 -65.42 -67.14 -67.99 -68.77 0.25 11 0 "[ . 1 . ]"
100 . 1 146 HIS C 1 147 THR N 1 147 THR CA 1 147 THR C -98.18 -18.18 -60.20 -69.05 -49.15 . . 0 "[ . 1 . ]"
101 . 1 147 THR C 1 148 GLU N 1 148 GLU CA 1 148 GLU C -103.37 -23.37 -52.56 -60.06 -47.59 . . 0 "[ . 1 . ]"
102 . 1 148 GLU C 1 149 GLY N 1 149 GLY CA 1 149 GLY C -106.36 -26.36 -60.22 -53.49 -56.85 . . 0 "[ . 1 . ]"
103 . 1 149 GLY C 1 150 ASN N 1 150 ASN CA 1 150 ASN C -101.28 -21.28 -63.74 -56.52 -58.63 . . 0 "[ . 1 . ]"
104 . 1 150 ASN C 1 151 ALA N 1 151 ALA CA 1 151 ALA C -107.74 -27.74 -62.81 -59.16 -60.92 . . 0 "[ . 1 . ]"
105 . 1 151 ALA C 1 152 LEU N 1 152 LEU CA 1 152 LEU C -104.04 -24.04 -62.77 -61.64 -64.17 . . 0 "[ . 1 . ]"
106 . 1 152 LEU C 1 153 ALA N 1 153 ALA CA 1 153 ALA C -103.20 -23.20 -60.38 -60.92 -63.32 . . 0 "[ . 1 . ]"
107 . 1 153 ALA C 1 154 ASP N 1 154 ASP CA 1 154 ASP C -108.38 -28.38 -61.39 -54.08 -55.69 . . 0 "[ . 1 . ]"
108 . 1 154 ASP C 1 155 LYS N 1 155 LYS CA 1 155 LYS C -104.93 -24.93 -61.41 -60.80 -62.19 . . 0 "[ . 1 . ]"
109 . 1 155 LYS C 1 156 LEU N 1 156 LEU CA 1 156 LEU C -104.39 -24.39 -67.56 -74.17 -60.52 . . 0 "[ . 1 . ]"
110 . 1 156 LEU C 1 157 ALA N 1 157 ALA CA 1 157 ALA C -109.24 -29.24 -65.19 -63.56 -63.89 . . 0 "[ . 1 . ]"
111 . 1 157 ALA C 1 158 THR N 1 158 THR CA 1 158 THR C -104.18 -24.18 -62.05 -61.76 -63.79 . . 0 "[ . 1 . ]"
112 . 1 158 THR C 1 159 GLN N 1 159 GLN CA 1 159 GLN C -103.92 -23.92 -63.38 -63.68 -65.23 . . 0 "[ . 1 . ]"
113 . 1 159 GLN C 1 160 GLY N 1 160 GLY CA 1 160 GLY C -116.86 -36.86 -60.99 -58.79 -60.13 . . 0 "[ . 1 . ]"
114 . 1 3 MET N 1 3 MET CA 1 3 MET C 1 4 GLY N -41.33 45.87 -34.37 -41.40 -25.92 0.07 9 0 "[ . 1 . ]"
115 . 1 8 GLY N 1 8 GLY CA 1 8 GLY C 1 9 VAL N 113.43 -166.57 -173.14 -166.84 -167.71 0.56 3 0 "[ . 1 . ]"
116 . 1 9 VAL N 1 9 VAL CA 1 9 VAL C 1 10 PHE N 93.11 173.11 140.97 132.23 146.27 . . 0 "[ . 1 . ]"
117 . 1 10 PHE N 1 10 PHE CA 1 10 PHE C 1 11 TYR N 98.48 178.48 140.37 146.41 143.87 . . 0 "[ . 1 . ]"
118 . 1 12 THR N 1 12 THR CA 1 12 THR C 1 13 ASP N 113.68 -166.32 149.68 151.60 150.75 . . 0 "[ . 1 . ]"
119 . 1 13 ASP N 1 13 ASP CA 1 13 ASP C 1 14 GLY N 111.42 -168.58 151.23 137.97 163.07 . . 0 "[ . 1 . ]"
120 . 1 15 SER N 1 15 SER CA 1 15 SER C 1 16 ALA N 95.46 175.46 152.08 138.60 162.72 . . 0 "[ . 1 . ]"
121 . 1 16 ALA N 1 16 ALA CA 1 16 ALA C 1 17 ILE N 100.37 -179.63 147.97 135.19 158.68 . . 0 "[ . 1 . ]"
122 . 1 17 ILE N 1 17 ILE CA 1 17 ILE C 1 18 LYS N 94.15 174.15 139.24 140.04 138.86 . . 0 "[ . 1 . ]"
123 . 1 19 SER N 1 19 SER CA 1 19 SER C 1 20 PRO N 101.29 -178.71 168.13 154.35 -177.71 1.00 19 0 "[ . 1 . ]"
124 . 1 23 THR N 1 23 THR CA 1 23 THR C 1 24 LYS N -50.34 29.66 -35.67 -48.19 -50.07 0.06 1 0 "[ . 1 . ]"
125 . 1 27 ASN N 1 27 ASN CA 1 27 ASN C 1 28 ALA N 91.83 171.83 126.58 135.96 129.20 . . 0 "[ . 1 . ]"
126 . 1 28 ALA N 1 28 ALA CA 1 28 ALA C 1 29 GLY N 105.99 -174.01 151.93 143.08 164.47 . . 0 "[ . 1 . ]"
127 . 1 29 GLY N 1 29 GLY CA 1 29 GLY C 1 30 MET N 122.08 -157.92 157.09 143.03 165.46 . . 0 "[ . 1 . ]"
128 . 1 30 MET N 1 30 MET CA 1 30 MET C 1 31 GLY N 109.73 -170.27 157.07 145.75 140.84 . . 0 "[ . 1 . ]"
129 . 1 31 GLY N 1 31 GLY CA 1 31 GLY C 1 32 ILE N 92.05 172.05 121.27 113.76 130.22 . . 0 "[ . 1 . ]"
130 . 1 32 ILE N 1 32 ILE CA 1 32 ILE C 1 33 VAL N 91.22 171.22 130.07 111.98 142.51 . . 0 "[ . 1 . ]"
131 . 1 33 VAL N 1 33 VAL CA 1 33 VAL C 1 34 HIS N 85.11 165.11 138.81 123.52 160.21 . . 0 "[ . 1 . ]"
132 . 1 34 HIS N 1 34 HIS CA 1 34 HIS C 1 35 ALA N 85.45 165.45 137.80 141.72 139.95 . . 0 "[ . 1 . ]"
133 . 1 35 ALA N 1 35 ALA CA 1 35 ALA C 1 36 THR N 101.13 -178.87 165.50 158.16 173.11 . . 0 "[ . 1 . ]"
134 . 1 36 THR N 1 36 THR CA 1 36 THR C 1 37 TYR N 119.38 -160.62 163.40 154.25 166.74 . . 0 "[ . 1 . ]"
135 . 1 38 LYS N 1 38 LYS CA 1 38 LYS C 1 39 PRO N 101.16 -178.84 179.85 178.57 -178.70 0.14 17 0 "[ . 1 . ]"
136 . 1 40 GLU N 1 40 GLU CA 1 40 GLU C 1 41 TYR N 106.74 -173.26 106.02 105.36 106.55 1.38 10 0 "[ . 1 . ]"
137 . 1 41 TYR N 1 41 TYR CA 1 41 TYR C 1 42 GLN N 82.38 162.38 124.39 123.76 123.75 . . 0 "[ . 1 . ]"
138 . 1 42 GLN N 1 42 GLN CA 1 42 GLN C 1 43 VAL N 104.47 -175.53 144.80 117.78 156.60 . . 0 "[ . 1 . ]"
139 . 1 43 VAL N 1 43 VAL CA 1 43 VAL C 1 44 LEU N 82.19 162.19 121.53 110.99 126.04 . . 0 "[ . 1 . ]"
140 . 1 44 LEU N 1 44 LEU CA 1 44 LEU C 1 45 ASN N -78.05 1.95 -41.28 -48.72 -34.18 . . 0 "[ . 1 . ]"
141 . 1 45 ASN N 1 45 ASN CA 1 45 ASN C 1 46 GLN N 118.88 -161.12 155.30 146.59 168.45 . . 0 "[ . 1 . ]"
142 . 1 46 GLN N 1 46 GLN CA 1 46 GLN C 1 47 TRP N 114.72 -165.28 145.07 137.80 154.72 . . 0 "[ . 1 . ]"
143 . 1 47 TRP N 1 47 TRP CA 1 47 TRP C 1 48 SER N 98.32 178.32 135.44 136.40 135.52 . . 0 "[ . 1 . ]"
144 . 1 48 SER N 1 48 SER CA 1 48 SER C 1 49 ILE N 80.21 160.21 135.37 125.45 145.34 . . 0 "[ . 1 . ]"
145 . 1 49 ILE N 1 49 ILE CA 1 49 ILE C 1 50 PRO N 85.41 165.41 95.17 86.94 112.12 . . 0 "[ . 1 . ]"
146 . 1 50 PRO N 1 50 PRO CA 1 50 PRO C 1 51 LEU N 98.77 178.77 136.01 128.16 148.32 . . 0 "[ . 1 . ]"
147 . 1 51 LEU N 1 51 LEU CA 1 51 LEU C 1 52 GLY N 94.42 -174.18 144.68 147.86 147.14 . . 0 "[ . 1 . ]"
148 . 1 54 HIS N 1 54 HIS CA 1 54 HIS C 1 55 THR N 122.00 -158.00 168.83 -177.56 179.07 . . 0 "[ . 1 . ]"
149 . 1 55 THR N 1 55 THR CA 1 55 THR C 1 56 ALA N 130.33 -149.67 170.39 170.04 169.44 . . 0 "[ . 1 . ]"
150 . 1 56 ALA N 1 56 ALA CA 1 56 ALA C 1 57 GLN N -78.49 1.51 -39.32 -39.72 -41.09 . . 0 "[ . 1 . ]"
151 . 1 57 GLN N 1 57 GLN CA 1 57 GLN C 1 58 MET N -80.57 -0.57 -54.29 -67.15 -40.61 . . 0 "[ . 1 . ]"
152 . 1 58 MET N 1 58 MET CA 1 58 MET C 1 59 ALA N -82.55 -2.55 -32.00 -29.20 -30.12 . . 0 "[ . 1 . ]"
153 . 1 59 ALA N 1 59 ALA CA 1 59 ALA C 1 60 GLU N -83.97 -3.97 -34.72 -45.86 -25.90 . . 0 "[ . 1 . ]"
154 . 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 ILE N -80.26 -0.26 -41.29 -42.82 -44.90 . . 0 "[ . 1 . ]"
155 . 1 61 ILE N 1 61 ILE CA 1 61 ILE C 1 62 ALA N -79.58 0.42 -34.52 -39.62 -28.17 . . 0 "[ . 1 . ]"
156 . 1 62 ALA N 1 62 ALA CA 1 62 ALA C 1 63 ALA N -77.07 2.93 -31.33 -39.31 -25.84 . . 0 "[ . 1 . ]"
157 . 1 63 ALA N 1 63 ALA CA 1 63 ALA C 1 64 VAL N -81.22 -1.22 -41.04 -48.18 -36.38 . . 0 "[ . 1 . ]"
158 . 1 64 VAL N 1 64 VAL CA 1 64 VAL C 1 65 GLU N -81.57 -1.57 -43.57 -50.46 -36.67 . . 0 "[ . 1 . ]"
159 . 1 65 GLU N 1 65 GLU CA 1 65 GLU C 1 66 PHE N -83.34 -3.34 -39.22 -43.94 -35.57 . . 0 "[ . 1 . ]"
160 . 1 66 PHE N 1 66 PHE CA 1 66 PHE C 1 67 ALA N -82.46 -2.46 -66.94 -65.34 -66.33 . . 0 "[ . 1 . ]"
161 . 1 67 ALA N 1 67 ALA CA 1 67 ALA C 1 68 CYS N -79.82 0.18 -23.91 -19.21 -27.63 . . 0 "[ . 1 . ]"
162 . 1 68 CYS N 1 68 CYS CA 1 68 CYS C 1 69 LYS N -87.77 -7.77 -59.34 -66.04 -52.64 . . 0 "[ . 1 . ]"
163 . 1 69 LYS N 1 69 LYS CA 1 69 LYS C 1 70 LYS N -80.56 -0.56 -44.84 -50.86 -38.88 . . 0 "[ . 1 . ]"
164 . 1 70 LYS N 1 70 LYS CA 1 70 LYS C 1 71 ALA N -77.31 2.69 -35.15 -42.12 -27.42 . . 0 "[ . 1 . ]"
165 . 1 71 ALA N 1 71 ALA CA 1 71 ALA C 1 72 LEU N -78.50 1.50 -63.29 -72.00 -57.13 . . 0 "[ . 1 . ]"
166 . 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 LYS N -64.28 15.72 -44.13 -48.51 -36.01 . . 0 "[ . 1 . ]"
167 . 1 74 ILE N 1 74 ILE CA 1 74 ILE C 1 75 PRO N 90.08 170.08 142.97 143.88 143.65 . . 0 "[ . 1 . ]"
168 . 1 77 PRO N 1 77 PRO CA 1 77 PRO C 1 78 VAL N 96.43 176.43 128.07 116.40 146.67 . . 0 "[ . 1 . ]"
169 . 1 78 VAL N 1 78 VAL CA 1 78 VAL C 1 79 LEU N 93.84 173.84 156.38 146.56 167.67 . . 0 "[ . 1 . ]"
170 . 1 79 LEU N 1 79 LEU CA 1 79 LEU C 1 80 VAL N 87.05 167.05 138.42 143.28 140.26 . . 0 "[ . 1 . ]"
171 . 1 80 VAL N 1 80 VAL CA 1 80 VAL C 1 81 ILE N 83.02 163.02 131.30 128.62 126.42 . . 0 "[ . 1 . ]"
172 . 1 81 ILE N 1 81 ILE CA 1 81 ILE C 1 82 THR N 79.01 159.01 137.17 132.08 144.29 . . 0 "[ . 1 . ]"
173 . 1 82 THR N 1 82 THR CA 1 82 THR C 1 83 ASP N 81.65 161.65 160.15 161.59 161.27 0.34 12 0 "[ . 1 . ]"
174 . 1 84 SER N 1 84 SER CA 1 84 SER C 1 85 PHE N 67.58 156.46 120.25 129.42 126.02 . . 0 "[ . 1 . ]"
175 . 1 85 PHE N 1 85 PHE CA 1 85 PHE C 1 86 TYR N -83.54 -3.54 -40.86 -40.60 -41.45 . . 0 "[ . 1 . ]"
176 . 1 86 TYR N 1 86 TYR CA 1 86 TYR C 1 87 VAL N -79.60 0.40 -49.81 -53.62 -56.76 . . 0 "[ . 1 . ]"
177 . 1 87 VAL N 1 87 VAL CA 1 87 VAL C 1 88 ALA N -79.88 0.12 -49.36 -60.95 -39.57 . . 0 "[ . 1 . ]"
178 . 1 88 ALA N 1 88 ALA CA 1 88 ALA C 1 89 GLU N -82.56 -2.56 -53.95 -57.62 -60.66 . . 0 "[ . 1 . ]"
179 . 1 90 SER N 1 90 SER CA 1 90 SER C 1 91 ALA N -79.91 0.09 -51.55 -59.65 -65.09 . . 0 "[ . 1 . ]"
180 . 1 91 ALA N 1 91 ALA CA 1 91 ALA C 1 92 ASN N -81.09 -1.09 -1.73 -1.19 -7.50 0.43 3 0 "[ . 1 . ]"
181 . 1 92 ASN N 1 92 ASN CA 1 92 ASN C 1 93 LYS N -72.36 7.64 -69.81 -73.77 -42.03 1.41 14 0 "[ . 1 . ]"
182 . 1 93 LYS N 1 93 LYS CA 1 93 LYS C 1 94 GLU N -64.58 15.42 -30.97 -35.53 -47.10 . . 0 "[ . 1 . ]"
183 . 1 95 LEU N 1 95 LEU CA 1 95 LEU C 1 96 PRO N -82.41 -2.41 -60.04 -60.20 -60.80 . . 0 "[ . 1 . ]"
184 . 1 96 PRO N 1 96 PRO CA 1 96 PRO C 1 97 TYR N -74.02 5.98 -31.94 -35.10 -36.12 . . 0 "[ . 1 . ]"
185 . 1 97 TYR N 1 97 TYR CA 1 97 TYR C 1 98 TRP N -83.43 -3.43 -38.23 -40.60 -42.01 . . 0 "[ . 1 . ]"
186 . 1 98 TRP N 1 98 TRP CA 1 98 TRP C 1 99 LYS N -83.53 -3.53 -48.96 -52.98 -42.25 . . 0 "[ . 1 . ]"
187 . 1 99 LYS N 1 99 LYS CA 1 99 LYS C 1 100 SER N -74.17 9.23 -41.90 -38.75 -39.89 . . 0 "[ . 1 . ]"
188 . 1 100 SER N 1 100 SER CA 1 100 SER C 1 101 ASN N -78.45 21.39 -37.72 -44.42 -28.31 . . 0 "[ . 1 . ]"
189 . 1 101 ASN N 1 101 ASN CA 1 101 ASN C 1 102 GLY N -40.13 39.87 8.01 -26.17 23.11 . . 0 "[ . 1 . ]"
190 . 1 103 PHE N 1 103 PHE CA 1 103 PHE C 1 104 VAL N -3.57 76.43 35.75 34.26 34.05 . . 0 "[ . 1 . ]"
191 . 1 114 ILE N 1 114 ILE CA 1 114 ILE C 1 115 SER N -86.64 -6.64 -43.18 -50.35 -38.10 . . 0 "[ . 1 . ]"
192 . 1 115 SER N 1 115 SER CA 1 115 SER C 1 116 LYS N -84.67 -4.67 -45.00 -50.18 -39.84 . . 0 "[ . 1 . ]"
193 . 1 116 LYS N 1 116 LYS CA 1 116 LYS C 1 117 TRP N -82.51 -2.51 -44.14 -54.06 -35.94 . . 0 "[ . 1 . ]"
194 . 1 117 TRP N 1 117 TRP CA 1 117 TRP C 1 118 LYS N -82.47 -2.47 -36.28 -42.39 -30.08 . . 0 "[ . 1 . ]"
195 . 1 118 LYS N 1 118 LYS CA 1 118 LYS C 1 119 SER N -80.64 -0.64 -43.14 -43.04 -44.28 . . 0 "[ . 1 . ]"
196 . 1 119 SER N 1 119 SER CA 1 119 SER C 1 120 ILE N -80.12 -0.12 -43.99 -48.10 -39.54 . . 0 "[ . 1 . ]"
197 . 1 120 ILE N 1 120 ILE CA 1 120 ILE C 1 121 ALA N -83.52 -3.52 -35.55 -40.13 -30.25 . . 0 "[ . 1 . ]"
198 . 1 121 ALA N 1 121 ALA CA 1 121 ALA C 1 122 GLU N -80.06 -0.06 -37.65 -43.40 -32.66 . . 0 "[ . 1 . ]"
199 . 1 122 GLU N 1 122 GLU CA 1 122 GLU C 1 123 CYS N -80.21 -0.21 -39.36 -45.84 -33.30 . . 0 "[ . 1 . ]"
200 . 1 123 CYS N 1 123 CYS CA 1 123 CYS C 1 124 LEU N -81.64 -1.64 -48.64 -47.11 -48.97 . . 0 "[ . 1 . ]"
201 . 1 124 LEU N 1 124 LEU CA 1 124 LEU C 1 125 SER N -80.64 -0.64 -33.51 -37.44 -27.01 . . 0 "[ . 1 . ]"
202 . 1 125 SER N 1 125 SER CA 1 125 SER C 1 126 MET N -81.44 -1.44 -33.34 -36.55 -26.61 . . 0 "[ . 1 . ]"
203 . 1 126 MET N 1 126 MET CA 1 126 MET C 1 127 LYS N -60.63 19.37 -33.96 -31.70 -32.43 . . 0 "[ . 1 . ]"
204 . 1 130 ILE N 1 130 ILE CA 1 130 ILE C 1 131 THR N 91.60 171.60 117.24 121.24 119.14 . . 0 "[ . 1 . ]"
205 . 1 131 THR N 1 131 THR CA 1 131 THR C 1 132 ILE N 85.41 165.41 142.43 129.65 151.16 . . 0 "[ . 1 . ]"
206 . 1 132 ILE N 1 132 ILE CA 1 132 ILE C 1 133 GLN N 88.08 168.08 136.98 128.13 145.70 . . 0 "[ . 1 . ]"
207 . 1 133 GLN N 1 133 GLN CA 1 133 GLN C 1 134 HIS N 95.80 175.80 158.76 164.96 163.07 . . 0 "[ . 1 . ]"
208 . 1 134 HIS N 1 134 HIS CA 1 134 HIS C 1 135 GLU N 84.88 164.88 133.75 131.39 128.56 . . 0 "[ . 1 . ]"
209 . 1 135 GLU N 1 135 GLU CA 1 135 GLU C 1 136 LYS N 80.66 -176.50 146.87 138.45 159.50 . . 0 "[ . 1 . ]"
210 . 1 145 ILE N 1 145 ILE CA 1 145 ILE C 1 146 HIS N -66.28 13.72 -34.56 -55.29 -10.04 . . 0 "[ . 1 . ]"
211 . 1 146 HIS N 1 146 HIS CA 1 146 HIS C 1 147 THR N -38.85 50.35 -30.88 -38.92 -21.46 0.07 2 0 "[ . 1 . ]"
212 . 1 147 THR N 1 147 THR CA 1 147 THR C 1 148 GLU N -85.15 -5.15 -44.08 -39.46 -40.24 . . 0 "[ . 1 . ]"
213 . 1 148 GLU N 1 148 GLU CA 1 148 GLU C 1 149 GLY N -80.09 -0.09 -44.68 -52.18 -36.46 . . 0 "[ . 1 . ]"
214 . 1 149 GLY N 1 149 GLY CA 1 149 GLY C 1 150 ASN N -85.16 -5.16 -36.26 -40.84 -24.85 . . 0 "[ . 1 . ]"
215 . 1 150 ASN N 1 150 ASN CA 1 150 ASN C 1 151 ALA N -84.21 -4.21 -38.87 -48.80 -32.46 . . 0 "[ . 1 . ]"
216 . 1 151 ALA N 1 151 ALA CA 1 151 ALA C 1 152 LEU N -78.12 1.88 -50.68 -55.47 -41.45 . . 0 "[ . 1 . ]"
217 . 1 152 LEU N 1 152 LEU CA 1 152 LEU C 1 153 ALA N -82.88 -2.88 -44.16 -48.84 -37.05 . . 0 "[ . 1 . ]"
218 . 1 153 ALA N 1 153 ALA CA 1 153 ALA C 1 154 ASP N -79.46 0.54 -39.45 -42.56 -35.74 . . 0 "[ . 1 . ]"
219 . 1 154 ASP N 1 154 ASP CA 1 154 ASP C 1 155 LYS N -74.80 5.20 -40.98 -49.32 -32.26 . . 0 "[ . 1 . ]"
220 . 1 155 LYS N 1 155 LYS CA 1 155 LYS C 1 156 LEU N -83.19 -3.19 -40.98 -48.01 -35.41 . . 0 "[ . 1 . ]"
221 . 1 156 LEU N 1 156 LEU CA 1 156 LEU C 1 157 ALA N -79.12 0.88 -38.20 -38.76 -39.86 . . 0 "[ . 1 . ]"
222 . 1 157 ALA N 1 157 ALA CA 1 157 ALA C 1 158 THR N -81.82 -1.82 -45.28 -62.73 -39.73 . . 0 "[ . 1 . ]"
223 . 1 158 THR N 1 158 THR CA 1 158 THR C 1 159 GLN N -83.89 -3.89 -41.05 -45.81 -30.94 . . 0 "[ . 1 . ]"
224 . 1 159 GLN N 1 159 GLN CA 1 159 GLN C 1 160 GLY N -76.02 3.98 -34.53 -40.05 -26.66 . . 0 "[ . 1 . ]"
225 . 1 160 GLY N 1 160 GLY CA 1 160 GLY C 1 161 SER N -64.78 15.22 -43.17 -59.20 -26.73 . . 0 "[ . 1 . ]"
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