NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
397946 |
1t4y   |
5141 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1t4y
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 197
_TA_constraint_stats_list.Viol_count 19
_TA_constraint_stats_list.Viol_total 13.48
_TA_constraint_stats_list.Viol_max 1.62
_TA_constraint_stats_list.Viol_rms 0.25
_TA_constraint_stats_list.Viol_average_all_restraints 0.07
_TA_constraint_stats_list.Viol_average_violations_only 0.71
_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 4 LEU C 1 5 SER N 1 5 SER CA 1 5 SER C -167.00 -47.00 -95.05 -95.05 -95.05 . . 0 "[ ]"
2 . 1 8 ALA C 1 9 LEU N 1 9 LEU CA 1 9 LEU C -125.00 -37.00 -66.06 -66.06 -66.06 . . 0 "[ ]"
3 . 1 10 ALA C 1 11 GLN N 1 11 GLN CA 1 11 GLN C -165.00 -41.00 -78.31 -78.31 -78.31 . . 0 "[ ]"
4 . 1 12 PRO C 1 13 LEU N 1 13 LEU CA 1 13 LEU C -136.00 -64.00 -62.60 -62.60 -62.60 1.40 1 0 "[ ]"
5 . 1 13 LEU C 1 14 LEU N 1 14 LEU CA 1 14 LEU C -174.00 -50.00 -89.13 -89.13 -89.13 . . 0 "[ ]"
6 . 1 14 LEU C 1 15 LEU N 1 15 LEU CA 1 15 LEU C -148.00 -88.00 -122.07 -122.07 -122.07 . . 0 "[ ]"
7 . 1 15 LEU C 1 16 GLN N 1 16 GLN CA 1 16 GLN C -164.00 -88.00 -135.63 -135.63 -135.63 . . 0 "[ ]"
8 . 1 16 GLN C 1 17 LEU N 1 17 LEU CA 1 17 LEU C -150.00 -82.00 -145.22 -145.22 -145.22 . . 0 "[ ]"
9 . 1 17 LEU C 1 18 PHE N 1 18 PHE CA 1 18 PHE C -125.00 -73.00 -94.24 -94.24 -94.24 . . 0 "[ ]"
10 . 1 18 PHE C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -176.00 -92.00 -132.30 -132.30 -132.30 . . 0 "[ ]"
11 . 1 22 ARG C 1 23 PRO N 1 23 PRO CA 1 23 PRO C -78.00 -42.00 -46.49 -46.49 -46.49 . . 0 "[ ]"
12 . 1 23 PRO C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -75.00 -55.00 -54.41 -54.41 -54.41 0.59 1 0 "[ ]"
13 . 1 24 LEU C 1 25 SER N 1 25 SER CA 1 25 SER C -74.00 -62.00 -63.69 -63.69 -63.69 . . 0 "[ ]"
14 . 1 25 SER C 1 26 GLN N 1 26 GLN CA 1 26 GLN C -74.00 -50.00 -64.62 -64.62 -64.62 . . 0 "[ ]"
15 . 1 26 GLN C 1 27 HIS N 1 27 HIS CA 1 27 HIS C -76.00 -56.00 -69.26 -69.26 -69.26 . . 0 "[ ]"
16 . 1 27 HIS C 1 28 ILE N 1 28 ILE CA 1 28 ILE C -82.00 -54.00 -63.69 -63.69 -63.69 . . 0 "[ ]"
17 . 1 28 ILE C 1 29 VAL N 1 29 VAL CA 1 29 VAL C -81.00 -57.00 -56.16 -56.16 -56.16 0.84 1 0 "[ ]"
18 . 1 29 VAL C 1 30 GLN N 1 30 GLN CA 1 30 GLN C -77.00 -53.00 -58.30 -58.30 -58.30 . . 0 "[ ]"
19 . 1 30 GLN C 1 31 ARG N 1 31 ARG CA 1 31 ARG C -73.00 -61.00 -62.90 -62.90 -62.90 . . 0 "[ ]"
20 . 1 31 ARG C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -82.00 -50.00 -63.36 -63.36 -63.36 . . 0 "[ ]"
21 . 1 32 VAL C 1 33 LYS N 1 33 LYS CA 1 33 LYS C -76.00 -48.00 -61.68 -61.68 -61.68 . . 0 "[ ]"
22 . 1 33 LYS C 1 34 ASN N 1 34 ASN CA 1 34 ASN C -76.00 -56.00 -64.12 -64.12 -64.12 . . 0 "[ ]"
23 . 1 34 ASN C 1 35 ILE N 1 35 ILE CA 1 35 ILE C -83.00 -51.00 -68.26 -68.26 -68.26 . . 0 "[ ]"
24 . 1 35 ILE C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -90.00 -46.00 -57.77 -57.77 -57.77 . . 0 "[ ]"
25 . 1 36 LEU C 1 37 ALA N 1 37 ALA CA 1 37 ALA C -114.00 -30.00 -67.95 -67.95 -67.95 . . 0 "[ ]"
26 . 1 42 THR C 1 43 VAL N 1 43 VAL CA 1 43 VAL C -161.00 -57.00 -127.44 -127.44 -127.44 . . 0 "[ ]"
27 . 1 44 PRO C 1 45 ILE N 1 45 ILE CA 1 45 ILE C -146.00 -62.00 -98.25 -98.25 -98.25 . . 0 "[ ]"
28 . 1 45 ILE C 1 46 SER N 1 46 SER CA 1 46 SER C -160.00 -52.00 -103.50 -103.50 -103.50 . . 0 "[ ]"
29 . 1 46 SER C 1 47 LEU N 1 47 LEU CA 1 47 LEU C -119.00 -87.00 -95.22 -95.22 -95.22 . . 0 "[ ]"
30 . 1 47 LEU C 1 48 GLN N 1 48 GLN CA 1 48 GLN C -144.00 -76.00 -127.26 -127.26 -127.26 . . 0 "[ ]"
31 . 1 48 GLN C 1 49 VAL N 1 49 VAL CA 1 49 VAL C -138.00 -58.00 -93.12 -93.12 -93.12 . . 0 "[ ]"
32 . 1 49 VAL C 1 50 ILE N 1 50 ILE CA 1 50 ILE C -165.00 -65.00 -119.03 -119.03 -119.03 . . 0 "[ ]"
33 . 1 50 ILE C 1 51 ASN N 1 51 ASN CA 1 51 ASN C -128.00 -44.00 -80.01 -80.01 -80.01 . . 0 "[ ]"
34 . 1 51 ASN C 1 52 VAL N 1 52 VAL CA 1 52 VAL C -96.00 -40.00 -55.17 -55.17 -55.17 . . 0 "[ ]"
35 . 1 55 GLN C 1 56 PRO N 1 56 PRO CA 1 56 PRO C -82.00 -38.00 -74.76 -74.76 -74.76 . . 0 "[ ]"
36 . 1 56 PRO C 1 57 GLN N 1 57 GLN CA 1 57 GLN C -80.00 -52.00 -72.76 -72.76 -72.76 . . 0 "[ ]"
37 . 1 57 GLN C 1 58 LEU N 1 58 LEU CA 1 58 LEU C -75.00 -59.00 -74.32 -74.32 -74.32 . . 0 "[ ]"
38 . 1 58 LEU C 1 59 VAL N 1 59 VAL CA 1 59 VAL C -86.00 -50.00 -65.35 -65.35 -65.35 . . 0 "[ ]"
39 . 1 59 VAL C 1 60 GLU N 1 60 GLU CA 1 60 GLU C -75.00 -55.00 -69.29 -69.29 -69.29 . . 0 "[ ]"
40 . 1 60 GLU C 1 61 TYR N 1 61 TYR CA 1 61 TYR C -84.00 -48.00 -55.31 -55.31 -55.31 . . 0 "[ ]"
41 . 1 61 TYR C 1 62 TYR N 1 62 TYR CA 1 62 TYR C -119.00 -51.00 -85.70 -85.70 -85.70 . . 0 "[ ]"
42 . 1 65 VAL C 1 66 VAL N 1 66 VAL CA 1 66 VAL C -159.00 -51.00 -105.29 -105.29 -105.29 . . 0 "[ ]"
43 . 1 68 PRO C 1 69 ALA N 1 69 ALA CA 1 69 ALA C -177.00 -81.00 -155.77 -155.77 -155.77 . . 0 "[ ]"
44 . 1 69 ALA C 1 70 LEU N 1 70 LEU CA 1 70 LEU C -164.00 -76.00 -126.98 -126.98 -126.98 . . 0 "[ ]"
45 . 1 70 LEU C 1 71 VAL N 1 71 VAL CA 1 71 VAL C -148.00 -80.00 -140.77 -140.77 -140.77 . . 0 "[ ]"
46 . 1 71 VAL C 1 72 LYS N 1 72 LYS CA 1 72 LYS C -137.00 -49.00 -90.11 -90.11 -90.11 . . 0 "[ ]"
47 . 1 76 GLY C 1 77 SER N 1 77 SER CA 1 77 SER C -144.00 -36.00 -71.69 -71.69 -71.69 . . 0 "[ ]"
48 . 1 78 ARG C 1 79 GLN N 1 79 GLN CA 1 79 GLN C -177.00 -85.00 -147.87 -147.87 -147.87 . . 0 "[ ]"
49 . 1 79 GLN C 1 80 VAL N 1 80 VAL CA 1 80 VAL C -140.00 -84.00 -125.84 -125.84 -125.84 . . 0 "[ ]"
50 . 1 80 VAL C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -118.00 -86.00 -110.01 -110.01 -110.01 . . 0 "[ ]"
51 . 1 85 ASP C 1 86 LEU N 1 86 LEU CA 1 86 LEU C -79.00 -43.00 -44.59 -44.59 -44.59 . . 0 "[ ]"
52 . 1 86 LEU C 1 87 THR N 1 87 THR CA 1 87 THR C -77.00 -61.00 -64.83 -64.83 -64.83 . . 0 "[ ]"
53 . 1 87 THR C 1 88 ASP N 1 88 ASP CA 1 88 ASP C -76.00 -56.00 -73.91 -73.91 -73.91 . . 0 "[ ]"
54 . 1 88 ASP C 1 89 GLN N 1 89 GLN CA 1 89 GLN C -73.00 -57.00 -68.39 -68.39 -68.39 . . 0 "[ ]"
55 . 1 89 GLN C 1 90 LEU N 1 90 LEU CA 1 90 LEU C -75.00 -55.00 -56.97 -56.97 -56.97 . . 0 "[ ]"
56 . 1 90 LEU C 1 91 ALA N 1 91 ALA CA 1 91 ALA C -85.00 -37.00 -53.61 -53.61 -53.61 . . 0 "[ ]"
57 . 1 91 ALA C 1 92 ASN N 1 92 ASN CA 1 92 ASN C -92.00 -48.00 -81.61 -81.61 -81.61 . . 0 "[ ]"
58 . 1 92 ASN C 1 93 GLN N 1 93 GLN CA 1 93 GLN C -78.00 -54.00 -79.24 -79.24 -79.24 1.24 1 0 "[ ]"
59 . 1 93 GLN C 1 94 LEU N 1 94 LEU CA 1 94 LEU C -74.00 -54.00 -52.77 -52.77 -52.77 1.23 1 0 "[ ]"
60 . 1 94 LEU C 1 95 PRO N 1 95 PRO CA 1 95 PRO C -71.00 -47.00 -47.29 -47.29 -47.29 . . 0 "[ ]"
61 . 1 96 GLN C 1 97 TRP N 1 97 TRP CA 1 97 TRP C -158.00 -18.00 -68.89 -68.89 -68.89 . . 0 "[ ]"
62 . 1 98 LEU C 1 99 VAL N 1 99 VAL CA 1 99 VAL C -141.00 -57.00 -74.03 -74.03 -74.03 . . 0 "[ ]"
63 . 1 103 GLY C 1 104 ILE N 1 104 ILE CA 1 104 ILE C -132.00 -56.00 -61.15 -61.15 -61.15 . . 0 "[ ]"
64 . 1 5 SER N 1 5 SER CA 1 5 SER C 1 6 PRO N 57.00 -167.00 132.13 132.13 132.13 . . 0 "[ ]"
65 . 1 9 LEU N 1 9 LEU CA 1 9 LEU C 1 10 ALA N 86.00 -170.00 143.28 143.28 143.28 . . 0 "[ ]"
66 . 1 11 GLN N 1 11 GLN CA 1 11 GLN C 1 12 PRO N 55.00 179.00 128.35 128.35 128.35 . . 0 "[ ]"
67 . 1 13 LEU N 1 13 LEU CA 1 13 LEU C 1 14 LEU N 79.00 167.00 125.05 125.05 125.05 . . 0 "[ ]"
68 . 1 14 LEU N 1 14 LEU CA 1 14 LEU C 1 15 LEU N 105.00 165.00 104.39 104.39 104.39 0.61 1 0 "[ ]"
69 . 1 15 LEU N 1 15 LEU CA 1 15 LEU C 1 16 GLN N 132.00 172.00 140.29 140.29 140.29 . . 0 "[ ]"
70 . 1 16 GLN N 1 16 GLN CA 1 16 GLN C 1 17 LEU N 96.00 176.00 165.37 165.37 165.37 . . 0 "[ ]"
71 . 1 17 LEU N 1 17 LEU CA 1 17 LEU C 1 18 PHE N 95.00 155.00 125.65 125.65 125.65 . . 0 "[ ]"
72 . 1 18 PHE N 1 18 PHE CA 1 18 PHE C 1 19 VAL N 107.00 155.00 121.40 121.40 121.40 . . 0 "[ ]"
73 . 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 ASP N 122.00 -166.00 162.75 162.75 162.75 . . 0 "[ ]"
74 . 1 23 PRO N 1 23 PRO CA 1 23 PRO C 1 24 LEU N -55.00 -7.00 -39.33 -39.33 -39.33 . . 0 "[ ]"
75 . 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 SER N -53.00 -25.00 -43.13 -43.13 -43.13 . . 0 "[ ]"
76 . 1 25 SER N 1 25 SER CA 1 25 SER C 1 26 GLN N -47.00 -27.00 -46.85 -46.85 -46.85 . . 0 "[ ]"
77 . 1 26 GLN N 1 26 GLN CA 1 26 GLN C 1 27 HIS N -60.00 -28.00 -27.58 -27.58 -27.58 0.42 1 0 "[ ]"
78 . 1 27 HIS N 1 27 HIS CA 1 27 HIS C 1 28 ILE N -58.00 -30.00 -56.06 -56.06 -56.06 . . 0 "[ ]"
79 . 1 28 ILE N 1 28 ILE CA 1 28 ILE C 1 29 VAL N -53.00 -25.00 -31.88 -31.88 -31.88 . . 0 "[ ]"
80 . 1 29 VAL N 1 29 VAL CA 1 29 VAL C 1 30 GLN N -47.00 -35.00 -47.39 -47.39 -47.39 0.39 1 0 "[ ]"
81 . 1 30 GLN N 1 30 GLN CA 1 30 GLN C 1 31 ARG N -56.00 -20.00 -42.15 -42.15 -42.15 . . 0 "[ ]"
82 . 1 31 ARG N 1 31 ARG CA 1 31 ARG C 1 32 VAL N -51.00 -31.00 -43.85 -43.85 -43.85 . . 0 "[ ]"
83 . 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 LYS N -57.00 -29.00 -51.72 -51.72 -51.72 . . 0 "[ ]"
84 . 1 33 LYS N 1 33 LYS CA 1 33 LYS C 1 34 ASN N -62.00 -14.00 -41.23 -41.23 -41.23 . . 0 "[ ]"
85 . 1 34 ASN N 1 34 ASN CA 1 34 ASN C 1 35 ILE N -55.00 -31.00 -44.70 -44.70 -44.70 . . 0 "[ ]"
86 . 1 35 ILE N 1 35 ILE CA 1 35 ILE C 1 36 LEU N -51.00 -27.00 -50.93 -50.93 -50.93 . . 0 "[ ]"
87 . 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 ALA N -73.00 3.00 -46.11 -46.11 -46.11 . . 0 "[ ]"
88 . 1 37 ALA N 1 37 ALA CA 1 37 ALA C 1 38 ALA N -59.00 -3.00 -8.74 -8.74 -8.74 . . 0 "[ ]"
89 . 1 43 VAL N 1 43 VAL CA 1 43 VAL C 1 44 PRO N 72.00 -164.00 84.45 84.45 84.45 . . 0 "[ ]"
90 . 1 45 ILE N 1 45 ILE CA 1 45 ILE C 1 46 SER N 110.00 166.00 147.59 147.59 147.59 . . 0 "[ ]"
91 . 1 46 SER N 1 46 SER CA 1 46 SER C 1 47 LEU N 95.00 147.00 112.13 112.13 112.13 . . 0 "[ ]"
92 . 1 47 LEU N 1 47 LEU CA 1 47 LEU C 1 48 GLN N 109.00 137.00 118.88 118.88 118.88 . . 0 "[ ]"
93 . 1 48 GLN N 1 48 GLN CA 1 48 GLN C 1 49 VAL N 107.00 143.00 127.68 127.68 127.68 . . 0 "[ ]"
94 . 1 49 VAL N 1 49 VAL CA 1 49 VAL C 1 50 ILE N 104.00 152.00 141.08 141.08 141.08 . . 0 "[ ]"
95 . 1 50 ILE N 1 50 ILE CA 1 50 ILE C 1 51 ASN N 105.00 153.00 122.34 122.34 122.34 . . 0 "[ ]"
96 . 1 51 ASN N 1 51 ASN CA 1 51 ASN C 1 52 VAL N 75.00 -177.00 103.85 103.85 103.85 . . 0 "[ ]"
97 . 1 52 VAL N 1 52 VAL CA 1 52 VAL C 1 53 ALA N -58.00 6.00 -28.96 -28.96 -28.96 . . 0 "[ ]"
98 . 1 56 PRO N 1 56 PRO CA 1 56 PRO C 1 57 GLN N -56.00 4.00 -3.71 -3.71 -3.71 . . 0 "[ ]"
99 . 1 57 GLN N 1 57 GLN CA 1 57 GLN C 1 58 LEU N -61.00 -17.00 -44.56 -44.56 -44.56 . . 0 "[ ]"
100 . 1 58 LEU N 1 58 LEU CA 1 58 LEU C 1 59 VAL N -60.00 -24.00 -23.88 -23.88 -23.88 0.12 1 0 "[ ]"
101 . 1 59 VAL N 1 59 VAL CA 1 59 VAL C 1 60 GLU N -47.00 -31.00 -43.58 -43.58 -43.58 . . 0 "[ ]"
102 . 1 60 GLU N 1 60 GLU CA 1 60 GLU C 1 61 TYR N -47.00 -19.00 -34.06 -34.06 -34.06 . . 0 "[ ]"
103 . 1 61 TYR N 1 61 TYR CA 1 61 TYR C 1 62 TYR N -45.00 -21.00 -45.58 -45.58 -45.58 0.58 1 0 "[ ]"
104 . 1 62 TYR N 1 62 TYR CA 1 62 TYR C 1 63 ARG N -55.00 41.00 18.47 18.47 18.47 . . 0 "[ ]"
105 . 1 66 VAL N 1 66 VAL CA 1 66 VAL C 1 67 THR N 72.00 -140.00 145.22 145.22 145.22 . . 0 "[ ]"
106 . 1 69 ALA N 1 69 ALA CA 1 69 ALA C 1 70 LEU N 89.00 -179.00 155.21 155.21 155.21 . . 0 "[ ]"
107 . 1 70 LEU N 1 70 LEU CA 1 70 LEU C 1 71 VAL N 105.00 149.00 142.69 142.69 142.69 . . 0 "[ ]"
108 . 1 71 VAL N 1 71 VAL CA 1 71 VAL C 1 72 LYS N 96.00 156.00 121.22 121.22 121.22 . . 0 "[ ]"
109 . 1 72 LYS N 1 72 LYS CA 1 72 LYS C 1 73 ILE N 103.00 155.00 129.08 129.08 129.08 . . 0 "[ ]"
110 . 1 77 SER N 1 77 SER CA 1 77 SER C 1 78 ARG N 88.00 172.00 162.09 162.09 162.09 . . 0 "[ ]"
111 . 1 79 GLN N 1 79 GLN CA 1 79 GLN C 1 80 VAL N 108.00 176.00 152.14 152.14 152.14 . . 0 "[ ]"
112 . 1 80 VAL N 1 80 VAL CA 1 80 VAL C 1 81 LEU N 104.00 144.00 115.48 115.48 115.48 . . 0 "[ ]"
113 . 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 SER N 114.00 162.00 126.94 126.94 126.94 . . 0 "[ ]"
114 . 1 86 LEU N 1 86 LEU CA 1 86 LEU C 1 87 THR N -59.00 -19.00 -46.54 -46.54 -46.54 . . 0 "[ ]"
115 . 1 87 THR N 1 87 THR CA 1 87 THR C 1 88 ASP N -56.00 -16.00 -36.12 -36.12 -36.12 . . 0 "[ ]"
116 . 1 88 ASP N 1 88 ASP CA 1 88 ASP C 1 89 GLN N -50.00 -34.00 -47.75 -47.75 -47.75 . . 0 "[ ]"
117 . 1 89 GLN N 1 89 GLN CA 1 89 GLN C 1 90 LEU N -49.00 -29.00 -43.76 -43.76 -43.76 . . 0 "[ ]"
118 . 1 90 LEU N 1 90 LEU CA 1 90 LEU C 1 91 ALA N -56.00 -24.00 -55.49 -55.49 -55.49 . . 0 "[ ]"
119 . 1 91 ALA N 1 91 ALA CA 1 91 ALA C 1 92 ASN N -66.00 -14.00 -35.91 -35.91 -35.91 . . 0 "[ ]"
120 . 1 92 ASN N 1 92 ASN CA 1 92 ASN C 1 93 GLN N -65.00 -1.00 -34.66 -34.66 -34.66 . . 0 "[ ]"
121 . 1 93 GLN N 1 93 GLN CA 1 93 GLN C 1 94 LEU N -60.00 -28.00 -33.20 -33.20 -33.20 . . 0 "[ ]"
122 . 1 94 LEU N 1 94 LEU CA 1 94 LEU C 1 95 PRO N -60.00 -24.00 -60.60 -60.60 -60.60 0.60 1 0 "[ ]"
123 . 1 95 PRO N 1 95 PRO CA 1 95 PRO C 1 96 GLN N -51.00 -19.00 -41.84 -41.84 -41.84 . . 0 "[ ]"
124 . 1 97 TRP N 1 97 TRP CA 1 97 TRP C 1 98 LEU N -54.00 22.00 -53.72 -53.72 -53.72 . . 0 "[ ]"
125 . 1 99 VAL N 1 99 VAL CA 1 99 VAL C 1 100 GLN N -49.00 31.00 1.11 1.11 1.11 . . 0 "[ ]"
126 . 1 104 ILE N 1 104 ILE CA 1 104 ILE C 1 105 PHE N 84.00 168.00 159.04 159.04 159.04 . . 0 "[ ]"
127 . 1 19 VAL N 1 19 VAL CA 1 19 VAL CB 1 19 VAL CG1 -80.00 -40.00 -49.32 -49.32 -49.32 . . 0 "[ ]"
128 . 1 29 VAL N 1 29 VAL CA 1 29 VAL CB 1 29 VAL CG1 160.00 -160.00 168.71 168.71 168.71 . . 0 "[ ]"
129 . 1 32 VAL N 1 32 VAL CA 1 32 VAL CB 1 32 VAL CG1 160.00 -160.00 173.36 173.36 173.36 . . 0 "[ ]"
130 . 1 43 VAL N 1 43 VAL CA 1 43 VAL CB 1 43 VAL CG1 -80.00 -40.00 -80.77 -80.77 -80.77 0.77 1 0 "[ ]"
131 . 1 49 VAL N 1 49 VAL CA 1 49 VAL CB 1 49 VAL CG1 160.00 -160.00 -170.79 -170.79 -170.79 . . 0 "[ ]"
132 . 1 52 VAL N 1 52 VAL CA 1 52 VAL CB 1 52 VAL CG1 -80.00 -40.00 -57.62 -57.62 -57.62 . . 0 "[ ]"
133 . 1 59 VAL N 1 59 VAL CA 1 59 VAL CB 1 59 VAL CG1 160.00 -160.00 177.62 177.62 177.62 . . 0 "[ ]"
134 . 1 66 VAL N 1 66 VAL CA 1 66 VAL CB 1 66 VAL CG1 -80.00 -40.00 -65.35 -65.35 -65.35 . . 0 "[ ]"
135 . 1 71 VAL N 1 71 VAL CA 1 71 VAL CB 1 71 VAL CG1 160.00 -160.00 -171.92 -171.92 -171.92 . . 0 "[ ]"
136 . 1 80 VAL N 1 80 VAL CA 1 80 VAL CB 1 80 VAL CG1 160.00 -160.00 -178.57 -178.57 -178.57 . . 0 "[ ]"
137 . 1 28 ILE N 1 28 ILE CA 1 28 ILE CB 1 28 ILE CG1 -90.00 -30.00 -70.53 -70.53 -70.53 . . 0 "[ ]"
138 . 1 35 ILE N 1 35 ILE CA 1 35 ILE CB 1 35 ILE CG1 -80.00 -40.00 -61.13 -61.13 -61.13 . . 0 "[ ]"
139 . 1 50 ILE N 1 50 ILE CA 1 50 ILE CB 1 50 ILE CG1 -80.00 -40.00 -51.45 -51.45 -51.45 . . 0 "[ ]"
140 . 1 73 ILE N 1 73 ILE CA 1 73 ILE CB 1 73 ILE CG1 30.00 90.00 29.97 29.97 29.97 0.03 1 0 "[ ]"
141 . 1 84 ILE N 1 84 ILE CA 1 84 ILE CB 1 84 ILE CG1 30.00 90.00 73.84 73.84 73.84 . . 0 "[ ]"
142 . 1 21 THR N 1 21 THR CA 1 21 THR CB 1 21 THR OG1 40.00 80.00 78.27 78.27 78.27 . . 0 "[ ]"
143 . 1 42 THR N 1 42 THR CA 1 42 THR CB 1 42 THR OG1 40.00 80.00 61.13 61.13 61.13 . . 0 "[ ]"
144 . 1 67 THR N 1 67 THR CA 1 67 THR CB 1 67 THR OG1 40.00 80.00 52.33 52.33 52.33 . . 0 "[ ]"
145 . 1 87 THR N 1 87 THR CA 1 87 THR CB 1 87 THR OG1 40.00 80.00 62.49 62.49 62.49 . . 0 "[ ]"
146 . 1 4 LEU N 1 4 LEU CA 1 4 LEU CB 1 4 LEU CG 160.00 -160.00 -159.06 -159.06 -159.06 0.94 1 0 "[ ]"
147 . 1 9 LEU N 1 9 LEU CA 1 9 LEU CB 1 9 LEU CG 40.00 80.00 46.96 46.96 46.96 . . 0 "[ ]"
148 . 1 11 GLN N 1 11 GLN CA 1 11 GLN CB 1 11 GLN CG -80.00 -40.00 -39.09 -39.09 -39.09 0.91 1 0 "[ ]"
149 . 1 13 LEU N 1 13 LEU CA 1 13 LEU CB 1 13 LEU CG 160.00 -160.00 -169.40 -169.40 -169.40 . . 0 "[ ]"
150 . 1 14 LEU N 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG -80.00 -40.00 -59.98 -59.98 -59.98 . . 0 "[ ]"
151 . 1 15 LEU N 1 15 LEU CA 1 15 LEU CB 1 15 LEU CG 160.00 -160.00 -165.41 -165.41 -165.41 . . 0 "[ ]"
152 . 1 16 GLN N 1 16 GLN CA 1 16 GLN CB 1 16 GLN CG -80.00 -40.00 -79.72 -79.72 -79.72 . . 0 "[ ]"
153 . 1 17 LEU N 1 17 LEU CA 1 17 LEU CB 1 17 LEU CG 160.00 -160.00 -177.76 -177.76 -177.76 . . 0 "[ ]"
154 . 1 18 PHE N 1 18 PHE CA 1 18 PHE CB 1 18 PHE CG -80.00 -40.00 -76.92 -76.92 -76.92 . . 0 "[ ]"
155 . 1 20 ASP N 1 20 ASP CA 1 20 ASP CB 1 20 ASP CG 40.00 80.00 63.69 63.69 63.69 . . 0 "[ ]"
156 . 1 22 ARG N 1 22 ARG CA 1 22 ARG CB 1 22 ARG CG 40.00 80.00 72.38 72.38 72.38 . . 0 "[ ]"
157 . 1 24 LEU N 1 24 LEU CA 1 24 LEU CB 1 24 LEU CG 160.00 -160.00 -172.89 -172.89 -172.89 . . 0 "[ ]"
158 . 1 26 GLN N 1 26 GLN CA 1 26 GLN CB 1 26 GLN CG -80.00 -40.00 -47.62 -47.62 -47.62 . . 0 "[ ]"
159 . 1 27 HIS N 1 27 HIS CA 1 27 HIS CB 1 27 HIS CG 150.00 -150.00 -148.38 -148.38 -148.38 1.62 1 0 "[ ]"
160 . 1 30 GLN N 1 30 GLN CA 1 30 GLN CB 1 30 GLN CG -80.00 -40.00 -68.44 -68.44 -68.44 . . 0 "[ ]"
161 . 1 31 ARG N 1 31 ARG CA 1 31 ARG CB 1 31 ARG CG -80.00 -40.00 -69.93 -69.93 -69.93 . . 0 "[ ]"
162 . 1 33 LYS N 1 33 LYS CA 1 33 LYS CB 1 33 LYS CG -80.00 -40.00 -72.13 -72.13 -72.13 . . 0 "[ ]"
163 . 1 34 ASN N 1 34 ASN CA 1 34 ASN CB 1 34 ASN CG -80.00 -40.00 -65.58 -65.58 -65.58 . . 0 "[ ]"
164 . 1 36 LEU N 1 36 LEU CA 1 36 LEU CB 1 36 LEU CG -80.00 -40.00 -65.62 -65.62 -65.62 . . 0 "[ ]"
165 . 1 46 SER N 1 46 SER CA 1 46 SER CB 1 46 SER OG 160.00 -160.00 179.99 179.99 179.99 . . 0 "[ ]"
166 . 1 54 ASP N 1 54 ASP CA 1 54 ASP CB 1 54 ASP CG -80.00 -40.00 -70.51 -70.51 -70.51 . . 0 "[ ]"
167 . 1 55 GLN N 1 55 GLN CA 1 55 GLN CB 1 55 GLN CG 40.00 80.00 68.50 68.50 68.50 . . 0 "[ ]"
168 . 1 57 GLN N 1 57 GLN CA 1 57 GLN CB 1 57 GLN CG 160.00 -160.00 174.67 174.67 174.67 . . 0 "[ ]"
169 . 1 58 LEU N 1 58 LEU CA 1 58 LEU CB 1 58 LEU CG 30.00 90.00 58.93 58.93 58.93 . . 0 "[ ]"
170 . 1 60 GLU N 1 60 GLU CA 1 60 GLU CB 1 60 GLU CG -80.00 -40.00 -69.70 -69.70 -69.70 . . 0 "[ ]"
171 . 1 61 TYR N 1 61 TYR CA 1 61 TYR CB 1 61 TYR CG 160.00 -160.00 -178.33 -178.33 -178.33 . . 0 "[ ]"
172 . 1 62 TYR N 1 62 TYR CA 1 62 TYR CB 1 62 TYR CG -80.00 -40.00 -61.96 -61.96 -61.96 . . 0 "[ ]"
173 . 1 63 ARG N 1 63 ARG CA 1 63 ARG CB 1 63 ARG CG -80.00 -40.00 -53.54 -53.54 -53.54 . . 0 "[ ]"
174 . 1 64 LEU N 1 64 LEU CA 1 64 LEU CB 1 64 LEU CG 160.00 -160.00 -159.60 -159.60 -159.60 0.40 1 0 "[ ]"
175 . 1 70 LEU N 1 70 LEU CA 1 70 LEU CB 1 70 LEU CG 160.00 -160.00 -161.78 -161.78 -161.78 . . 0 "[ ]"
176 . 1 72 LYS N 1 72 LYS CA 1 72 LYS CB 1 72 LYS CG 160.00 -160.00 -175.44 -175.44 -175.44 . . 0 "[ ]"
177 . 1 77 SER N 1 77 SER CA 1 77 SER CB 1 77 SER OG 160.00 -160.00 159.53 159.53 159.53 0.47 1 0 "[ ]"
178 . 1 78 ARG N 1 78 ARG CA 1 78 ARG CB 1 78 ARG CG 160.00 -160.00 -160.54 -160.54 -160.54 . . 0 "[ ]"
179 . 1 79 GLN N 1 79 GLN CA 1 79 GLN CB 1 79 GLN CG -80.00 -40.00 -53.98 -53.98 -53.98 . . 0 "[ ]"
180 . 1 81 LEU N 1 81 LEU CA 1 81 LEU CB 1 81 LEU CG -80.00 -40.00 -49.77 -49.77 -49.77 . . 0 "[ ]"
181 . 1 85 ASP N 1 85 ASP CA 1 85 ASP CB 1 85 ASP CG 40.00 80.00 67.31 67.31 67.31 . . 0 "[ ]"
182 . 1 86 LEU N 1 86 LEU CA 1 86 LEU CB 1 86 LEU CG -80.00 -40.00 -52.66 -52.66 -52.66 . . 0 "[ ]"
183 . 1 88 ASP N 1 88 ASP CA 1 88 ASP CB 1 88 ASP CG -80.00 -40.00 -72.47 -72.47 -72.47 . . 0 "[ ]"
184 . 1 90 LEU N 1 90 LEU CA 1 90 LEU CB 1 90 LEU CG 160.00 -160.00 177.34 177.34 177.34 . . 0 "[ ]"
185 . 1 92 ASN N 1 92 ASN CA 1 92 ASN CB 1 92 ASN CG -80.00 -40.00 -80.32 -80.32 -80.32 0.32 1 0 "[ ]"
186 . 1 93 GLN N 1 93 GLN CA 1 93 GLN CB 1 93 GLN CG -80.00 -40.00 -74.29 -74.29 -74.29 . . 0 "[ ]"
187 . 1 94 LEU N 1 94 LEU CA 1 94 LEU CB 1 94 LEU CG 160.00 -160.00 168.61 168.61 168.61 . . 0 "[ ]"
188 . 1 96 GLN N 1 96 GLN CA 1 96 GLN CB 1 96 GLN CG -80.00 -40.00 -59.46 -59.46 -59.46 . . 0 "[ ]"
189 . 1 97 TRP N 1 97 TRP CA 1 97 TRP CB 1 97 TRP CG -80.00 -40.00 -55.79 -55.79 -55.79 . . 0 "[ ]"
190 . 1 98 LEU N 1 98 LEU CA 1 98 LEU CB 1 98 LEU CG -80.00 -40.00 -59.92 -59.92 -59.92 . . 0 "[ ]"
191 . 1 100 GLN N 1 100 GLN CA 1 100 GLN CB 1 100 GLN CG -80.00 -40.00 -72.05 -72.05 -72.05 . . 0 "[ ]"
192 . 1 101 GLN N 1 101 GLN CA 1 101 GLN CB 1 101 GLN CG -80.00 -40.00 -70.02 -70.02 -70.02 . . 0 "[ ]"
193 . 1 102 GLU N 1 102 GLU CA 1 102 GLU CB 1 102 GLU CG -80.00 -40.00 -60.91 -60.91 -60.91 . . 0 "[ ]"
194 . 1 28 ILE CA 1 28 ILE CB 1 28 ILE CG1 1 28 ILE CD1 160.00 -160.00 171.09 171.09 171.09 . . 0 "[ ]"
195 . 1 35 ILE CA 1 35 ILE CB 1 35 ILE CG1 1 35 ILE CD1 160.00 -160.00 171.63 171.63 171.63 . . 0 "[ ]"
196 . 1 50 ILE CA 1 50 ILE CB 1 50 ILE CG1 1 50 ILE CD1 160.00 -160.00 -165.49 -165.49 -165.49 . . 0 "[ ]"
197 . 1 84 ILE CA 1 84 ILE CB 1 84 ILE CG1 1 84 ILE CD1 160.00 -160.00 173.70 173.70 173.70 . . 0 "[ ]"
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