NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
642251 |
6prp   |
30636 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_6prp
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 153
_TA_constraint_stats_list.Viol_count 488
_TA_constraint_stats_list.Viol_total 18616.63
_TA_constraint_stats_list.Viol_max 7.87
_TA_constraint_stats_list.Viol_rms 0.91
_TA_constraint_stats_list.Viol_average_all_restraints 0.30
_TA_constraint_stats_list.Viol_average_violations_only 1.91
_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 25 GLN C 1 26 ASP N 1 26 ASP CA 1 26 ASP C -149.50 -77.40 -89.40 -82.74 -85.18 1.34 20 0 "[ . 1 . 2]"
2 . 1 26 ASP N 1 26 ASP CA 1 26 ASP C 1 27 LEU N 115.20 174.60 142.02 114.79 158.65 0.41 19 0 "[ . 1 . 2]"
3 . 1 26 ASP C 1 27 LEU N 1 27 LEU CA 1 27 LEU C -152.50 -112.50 -125.61 -112.27 -116.94 3.60 14 0 "[ . 1 . 2]"
4 . 1 27 LEU N 1 27 LEU CA 1 27 LEU C 1 28 TYR N 127.70 176.30 144.69 146.90 145.07 . . 0 "[ . 1 . 2]"
5 . 1 27 LEU C 1 28 TYR N 1 28 TYR CA 1 28 TYR C -147.50 -94.40 -123.05 -139.81 -96.71 . . 0 "[ . 1 . 2]"
6 . 1 28 TYR N 1 28 TYR CA 1 28 TYR C 1 29 ALA N 123.00 163.00 124.94 121.75 120.87 2.36 9 0 "[ . 1 . 2]"
7 . 1 28 TYR C 1 29 ALA N 1 29 ALA CA 1 29 ALA C -165.60 -125.60 -154.39 -163.10 -143.81 . . 0 "[ . 1 . 2]"
8 . 1 29 ALA N 1 29 ALA CA 1 29 ALA C 1 30 THR N 130.20 170.20 163.81 169.03 167.35 1.41 17 0 "[ . 1 . 2]"
9 . 1 29 ALA C 1 30 THR N 1 30 THR CA 1 30 THR C -134.80 -66.20 -99.23 -108.77 -112.14 . . 0 "[ . 1 . 2]"
10 . 1 30 THR N 1 30 THR CA 1 30 THR C 1 31 LEU N 110.00 150.00 143.95 143.79 142.35 2.44 18 0 "[ . 1 . 2]"
11 . 1 30 THR C 1 31 LEU N 1 31 LEU CA 1 31 LEU C -149.60 -109.60 -112.72 -123.13 -106.76 2.84 4 0 "[ . 1 . 2]"
12 . 1 31 LEU N 1 31 LEU CA 1 31 LEU C 1 32 ASP N 113.50 153.50 116.83 110.96 124.97 2.54 15 0 "[ . 1 . 2]"
13 . 1 31 LEU C 1 32 ASP N 1 32 ASP CA 1 32 ASP C -120.40 -63.80 -83.30 -75.81 -79.32 . . 0 "[ . 1 . 2]"
14 . 1 32 ASP N 1 32 ASP CA 1 32 ASP C 1 33 VAL N 101.90 141.90 106.54 101.81 101.41 2.43 4 0 "[ . 1 . 2]"
15 . 1 32 ASP C 1 33 VAL N 1 33 VAL CA 1 33 VAL C -142.20 -99.90 -114.21 -110.60 -113.04 0.83 17 0 "[ . 1 . 2]"
16 . 1 33 VAL N 1 33 VAL CA 1 33 VAL C 1 34 PRO N 103.90 156.20 116.46 116.74 113.74 . . 0 "[ . 1 . 2]"
17 . 1 34 PRO N 1 34 PRO CA 1 34 PRO C 1 35 ALA N 127.20 167.20 142.21 138.35 148.44 . . 0 "[ . 1 . 2]"
18 . 1 34 PRO C 1 35 ALA N 1 35 ALA CA 1 35 ALA C -77.10 -37.10 -49.92 -53.75 -46.13 . . 0 "[ . 1 . 2]"
19 . 1 35 ALA N 1 35 ALA CA 1 35 ALA C 1 36 PRO N -62.50 -22.50 -47.71 -47.97 -49.17 . . 0 "[ . 1 . 2]"
20 . 1 36 PRO N 1 36 PRO CA 1 36 PRO C 1 37 ILE N -55.00 -15.00 -45.30 -55.16 -39.25 0.16 17 0 "[ . 1 . 2]"
21 . 1 37 ILE N 1 37 ILE CA 1 37 ILE C 1 38 ALA N -60.10 -20.10 -31.07 -36.20 -24.73 . . 0 "[ . 1 . 2]"
22 . 1 37 ILE C 1 38 ALA N 1 38 ALA CA 1 38 ALA C -86.20 -46.20 -68.73 -73.48 -64.10 . . 0 "[ . 1 . 2]"
23 . 1 38 ALA N 1 38 ALA CA 1 38 ALA C 1 39 VAL N -59.60 -19.60 -44.00 -42.72 -44.02 . . 0 "[ . 1 . 2]"
24 . 1 38 ALA C 1 39 VAL N 1 39 VAL CA 1 39 VAL C -87.70 -47.70 -70.08 -74.54 -64.30 . . 0 "[ . 1 . 2]"
25 . 1 39 VAL N 1 39 VAL CA 1 39 VAL C 1 40 VAL N -55.60 -15.60 -52.11 -56.29 -40.99 0.69 8 0 "[ . 1 . 2]"
26 . 1 39 VAL C 1 40 VAL N 1 40 VAL CA 1 40 VAL C -100.80 -60.80 -77.13 -86.97 -69.47 . . 0 "[ . 1 . 2]"
27 . 1 40 VAL N 1 40 VAL CA 1 40 VAL C 1 41 GLY N -40.80 7.80 -27.40 -26.28 -29.68 . . 0 "[ . 1 . 2]"
28 . 1 42 GLY C 1 43 LYS N 1 43 LYS CA 1 43 LYS C -136.70 -81.90 -126.12 -139.73 -82.79 3.03 17 0 "[ . 1 . 2]"
29 . 1 43 LYS N 1 43 LYS CA 1 43 LYS C 1 44 VAL N 120.60 161.30 145.73 134.20 158.93 . . 0 "[ . 1 . 2]"
30 . 1 43 LYS C 1 44 VAL N 1 44 VAL CA 1 44 VAL C -158.20 -118.20 -131.72 -129.29 -133.05 . . 0 "[ . 1 . 2]"
31 . 1 44 VAL N 1 44 VAL CA 1 44 VAL C 1 45 ARG N 127.90 167.90 149.52 144.61 143.57 0.33 8 0 "[ . 1 . 2]"
32 . 1 44 VAL C 1 45 ARG N 1 45 ARG CA 1 45 ARG C -103.90 -63.90 -87.00 -99.38 -73.72 . . 0 "[ . 1 . 2]"
33 . 1 45 ARG N 1 45 ARG CA 1 45 ARG C 1 46 ALA N 108.10 150.70 119.17 109.04 141.48 . . 0 "[ . 1 . 2]"
34 . 1 45 ARG C 1 46 ALA N 1 46 ALA CA 1 46 ALA C -155.80 -103.80 -105.32 -129.77 -99.98 3.82 12 0 "[ . 1 . 2]"
35 . 1 46 ALA N 1 46 ALA CA 1 46 ALA C 1 47 MET N 113.60 164.10 147.44 151.71 146.38 0.56 3 0 "[ . 1 . 2]"
36 . 1 46 ALA C 1 47 MET N 1 47 MET CA 1 47 MET C -106.10 -66.10 -98.28 -108.71 -83.02 2.61 4 0 "[ . 1 . 2]"
37 . 1 47 MET N 1 47 MET CA 1 47 MET C 1 48 THR N 106.20 153.30 115.24 103.23 126.03 2.97 19 0 "[ . 1 . 2]"
38 . 1 47 MET C 1 48 THR N 1 48 THR CA 1 48 THR C -155.90 -112.20 -115.21 -120.83 -124.52 3.34 7 0 "[ . 1 . 2]"
39 . 1 48 THR N 1 48 THR CA 1 48 THR C 1 49 LEU N 148.30 -171.70 177.20 179.02 177.94 . . 0 "[ . 1 . 2]"
40 . 1 48 THR C 1 49 LEU N 1 49 LEU CA 1 49 LEU C -82.50 -42.50 -71.81 -81.81 -62.90 . . 0 "[ . 1 . 2]"
41 . 1 49 LEU N 1 49 LEU CA 1 49 LEU C 1 50 GLU N -42.40 -2.10 -18.31 -10.43 -17.82 . . 0 "[ . 1 . 2]"
42 . 1 49 LEU C 1 50 GLU N 1 50 GLU CA 1 50 GLU C -119.80 -79.80 -91.90 -117.43 -78.67 1.13 4 0 "[ . 1 . 2]"
43 . 1 50 GLU N 1 50 GLU CA 1 50 GLU C 1 51 GLY N -17.10 29.60 -16.67 -20.59 -0.32 3.49 7 0 "[ . 1 . 2]"
44 . 1 50 GLU C 1 51 GLY N 1 51 GLY CA 1 51 GLY C 64.40 154.80 134.32 133.07 129.16 0.76 16 0 "[ . 1 . 2]"
45 . 1 51 GLY N 1 51 GLY CA 1 51 GLY C 1 52 PRO N 150.00 -150.00 -161.76 177.73 -149.56 0.44 20 0 "[ . 1 . 2]"
46 . 1 52 PRO N 1 52 PRO CA 1 52 PRO C 1 53 VAL N 121.80 161.80 135.50 141.23 136.33 . . 0 "[ . 1 . 2]"
47 . 1 52 PRO C 1 53 VAL N 1 53 VAL CA 1 53 VAL C -151.70 -111.70 -134.90 -139.61 -130.13 . . 0 "[ . 1 . 2]"
48 . 1 53 VAL N 1 53 VAL CA 1 53 VAL C 1 54 GLU N 130.00 170.00 141.86 157.15 147.82 4.97 11 0 "[ . 1 . 2]"
49 . 1 53 VAL C 1 54 GLU N 1 54 GLU CA 1 54 GLU C -112.80 -62.90 -95.40 -112.18 -77.41 . . 0 "[ . 1 . 2]"
50 . 1 54 GLU N 1 54 GLU CA 1 54 GLU C 1 55 VAL N 106.20 151.60 109.30 104.02 116.47 2.18 16 0 "[ . 1 . 2]"
51 . 1 54 GLU C 1 55 VAL N 1 55 VAL CA 1 55 VAL C -145.40 -97.90 -94.13 -93.51 -94.33 7.87 11 5 "[ . *1+ * . * -]"
52 . 1 55 VAL N 1 55 VAL CA 1 55 VAL C 1 56 ALA N 103.90 153.50 120.45 112.21 135.12 . . 0 "[ . 1 . 2]"
53 . 1 55 VAL C 1 56 ALA N 1 56 ALA CA 1 56 ALA C -121.50 -65.00 -68.57 -65.06 -65.25 1.43 4 0 "[ . 1 . 2]"
54 . 1 56 ALA N 1 56 ALA CA 1 56 ALA C 1 57 VAL N 102.20 143.30 103.07 99.69 109.20 2.51 3 0 "[ . 1 . 2]"
55 . 1 56 ALA C 1 57 VAL N 1 57 VAL CA 1 57 VAL C -127.70 -55.50 -76.47 -75.16 -76.80 . . 0 "[ . 1 . 2]"
56 . 1 57 VAL N 1 57 VAL CA 1 57 VAL C 1 58 PRO N 109.20 149.20 124.34 117.28 132.09 . . 0 "[ . 1 . 2]"
57 . 1 58 PRO N 1 58 PRO CA 1 58 PRO C 1 59 PRO N 129.60 169.60 154.08 151.62 146.49 . . 0 "[ . 1 . 2]"
58 . 1 61 THR C 1 62 GLN N 1 62 GLN CA 1 62 GLN C -151.50 -85.80 -96.44 -95.18 -102.94 1.04 2 0 "[ . 1 . 2]"
59 . 1 62 GLN N 1 62 GLN CA 1 62 GLN C 1 63 ALA N 129.70 -178.00 158.59 163.30 162.18 . . 0 "[ . 1 . 2]"
60 . 1 62 GLN C 1 63 ALA N 1 63 ALA CA 1 63 ALA C -77.60 -37.60 -69.61 -70.69 -71.82 1.11 8 0 "[ . 1 . 2]"
61 . 1 63 ALA N 1 63 ALA CA 1 63 ALA C 1 64 GLY N 115.50 155.50 128.11 114.76 149.21 0.74 3 0 "[ . 1 . 2]"
62 . 1 63 ALA C 1 64 GLY N 1 64 GLY CA 1 64 GLY C 73.20 113.20 105.77 100.20 94.82 1.81 12 0 "[ . 1 . 2]"
63 . 1 64 GLY N 1 64 GLY CA 1 64 GLY C 1 65 ARG N -28.60 11.40 -3.21 -24.95 10.66 . . 0 "[ . 1 . 2]"
64 . 1 64 GLY C 1 65 ARG N 1 65 ARG CA 1 65 ARG C -91.40 -51.40 -69.43 -79.25 -61.24 . . 0 "[ . 1 . 2]"
65 . 1 65 ARG N 1 65 ARG CA 1 65 ARG C 1 66 LYS N 119.70 159.70 158.46 161.85 161.27 3.35 8 0 "[ . 1 . 2]"
66 . 1 65 ARG C 1 66 LYS N 1 66 LYS CA 1 66 LYS C -128.80 -83.00 -126.67 -129.06 -130.19 3.11 10 0 "[ . 1 . 2]"
67 . 1 66 LYS N 1 66 LYS CA 1 66 LYS C 1 67 LEU N 99.50 143.40 133.16 104.35 143.53 0.13 17 0 "[ . 1 . 2]"
68 . 1 66 LYS C 1 67 LEU N 1 67 LEU CA 1 67 LEU C -124.70 -77.00 -116.78 -117.91 -119.89 2.60 20 0 "[ . 1 . 2]"
69 . 1 67 LEU N 1 67 LEU CA 1 67 LEU C 1 68 ARG N 101.20 151.70 122.56 97.35 145.24 3.85 5 0 "[ . 1 . 2]"
70 . 1 67 LEU C 1 68 ARG N 1 68 ARG CA 1 68 ARG C -141.60 -71.00 -111.05 -97.01 -108.37 . . 0 "[ . 1 . 2]"
71 . 1 68 ARG N 1 68 ARG CA 1 68 ARG C 1 69 LEU N 102.90 145.00 104.51 98.95 124.27 3.95 4 0 "[ . 1 . 2]"
72 . 1 68 ARG C 1 69 LEU N 1 69 LEU CA 1 69 LEU C -120.00 -69.20 -80.40 -79.14 -81.08 0.88 17 0 "[ . 1 . 2]"
73 . 1 69 LEU N 1 69 LEU CA 1 69 LEU C 1 70 LYS N 85.10 145.00 85.21 84.22 84.04 6.28 10 1 "[ . + . 2]"
74 . 1 69 LEU C 1 70 LYS N 1 70 LYS CA 1 70 LYS C -81.00 -40.70 -71.32 -79.32 -62.29 . . 0 "[ . 1 . 2]"
75 . 1 70 LYS N 1 70 LYS CA 1 70 LYS C 1 71 GLY N 114.30 154.30 130.85 114.11 144.15 0.19 11 0 "[ . 1 . 2]"
76 . 1 70 LYS C 1 71 GLY N 1 71 GLY CA 1 71 GLY C 56.20 100.80 67.52 66.81 65.41 . . 0 "[ . 1 . 2]"
77 . 1 71 GLY N 1 71 GLY CA 1 71 GLY C 1 72 LYS N -16.10 32.80 24.50 32.05 28.82 1.72 14 0 "[ . 1 . 2]"
78 . 1 73 GLY C 1 74 PHE N 1 74 PHE CA 1 74 PHE C -94.70 -51.20 -71.86 -95.85 -60.17 1.15 12 0 "[ . 1 . 2]"
79 . 1 74 PHE N 1 74 PHE CA 1 74 PHE C 1 75 PRO N 118.20 167.10 137.82 119.02 153.41 . . 0 "[ . 1 . 2]"
80 . 1 75 PRO N 1 75 PRO CA 1 75 PRO C 1 76 GLY N 129.30 169.30 141.31 127.07 160.19 2.23 2 0 "[ . 1 . 2]"
81 . 1 77 PRO C 1 78 ALA N 1 78 ALA CA 1 78 ALA C -119.10 -77.10 -89.48 -93.29 -97.55 2.32 20 0 "[ . 1 . 2]"
82 . 1 78 ALA N 1 78 ALA CA 1 78 ALA C 1 79 GLY N -25.40 21.80 -18.09 -28.96 12.64 3.56 12 0 "[ . 1 . 2]"
83 . 1 79 GLY C 1 80 ARG N 1 80 ARG CA 1 80 ARG C -125.00 -43.30 -83.34 -78.87 -86.45 4.43 7 0 "[ . 1 . 2]"
84 . 1 80 ARG N 1 80 ARG CA 1 80 ARG C 1 81 GLY N 113.20 173.20 157.47 122.55 170.73 . . 0 "[ . 1 . 2]"
85 . 1 80 ARG C 1 81 GLY N 1 81 GLY CA 1 81 GLY C -178.70 -47.40 -80.01 -88.02 -68.56 . . 0 "[ . 1 . 2]"
86 . 1 81 GLY N 1 81 GLY CA 1 81 GLY C 1 82 ASP N 126.60 -158.20 -159.52 -169.47 -153.60 4.60 1 0 "[ . 1 . 2]"
87 . 1 81 GLY C 1 82 ASP N 1 82 ASP CA 1 82 ASP C -170.40 -101.30 -119.51 -120.29 -121.43 . . 0 "[ . 1 . 2]"
88 . 1 82 ASP N 1 82 ASP CA 1 82 ASP C 1 83 LEU N 129.10 169.10 146.07 126.50 169.70 2.60 12 0 "[ . 1 . 2]"
89 . 1 82 ASP C 1 83 LEU N 1 83 LEU CA 1 83 LEU C -140.90 -100.80 -116.03 -101.24 -113.75 3.03 12 0 "[ . 1 . 2]"
90 . 1 83 LEU N 1 83 LEU CA 1 83 LEU C 1 84 TYR N 108.60 148.60 109.19 104.60 118.21 4.00 10 0 "[ . 1 . 2]"
91 . 1 83 LEU C 1 84 TYR N 1 84 TYR CA 1 84 TYR C -131.30 -91.30 -94.82 -102.77 -89.28 2.02 10 0 "[ . 1 . 2]"
92 . 1 84 TYR N 1 84 TYR CA 1 84 TYR C 1 85 LEU N 109.70 151.20 111.42 105.75 123.66 3.95 19 0 "[ . 1 . 2]"
93 . 1 84 TYR C 1 85 LEU N 1 85 LEU CA 1 85 LEU C -129.70 -89.70 -111.89 -127.22 -97.23 . . 0 "[ . 1 . 2]"
94 . 1 85 LEU N 1 85 LEU CA 1 85 LEU C 1 86 GLU N 106.50 146.50 120.51 106.71 141.85 . . 0 "[ . 1 . 2]"
95 . 1 85 LEU C 1 86 GLU N 1 86 GLU CA 1 86 GLU C -123.80 -80.20 -87.27 -111.44 -77.32 2.88 6 0 "[ . 1 . 2]"
96 . 1 86 GLU N 1 86 GLU CA 1 86 GLU C 1 87 VAL N 93.60 133.60 112.37 112.40 110.99 . . 0 "[ . 1 . 2]"
97 . 1 86 GLU C 1 87 VAL N 1 87 VAL CA 1 87 VAL C -109.20 -50.50 -63.61 -71.20 -57.58 . . 0 "[ . 1 . 2]"
98 . 1 87 VAL N 1 87 VAL CA 1 87 VAL C 1 88 ARG N 106.10 146.10 113.31 104.27 127.94 1.83 6 0 "[ . 1 . 2]"
99 . 1 87 VAL C 1 88 ARG N 1 88 ARG CA 1 88 ARG C -141.90 -91.80 -113.62 -110.15 -113.22 . . 0 "[ . 1 . 2]"
100 . 1 88 ARG N 1 88 ARG CA 1 88 ARG C 1 89 ILE N 94.50 149.40 109.57 100.02 117.78 . . 0 "[ . 1 . 2]"
101 . 1 88 ARG C 1 89 ILE N 1 89 ILE CA 1 89 ILE C -117.60 -77.60 -76.55 -79.15 -74.42 3.18 11 0 "[ . 1 . 2]"
102 . 1 89 ILE N 1 89 ILE CA 1 89 ILE C 1 90 THR N 103.20 143.20 127.47 126.14 123.19 0.60 6 0 "[ . 1 . 2]"
103 . 1 3 ASP N 1 3 ASP CA 1 3 ASP CB 1 3 ASP CG 160.00 -160.00 179.00 177.54 176.82 . . 0 "[ . 1 . 2]"
104 . 1 3 ASP CA 1 3 ASP CB 1 3 ASP CG 1 3 ASP OD1 40.00 80.00 71.00 70.76 70.26 1.76 14 0 "[ . 1 . 2]"
105 . 1 6 ASP N 1 6 ASP CA 1 6 ASP CB 1 6 ASP CG 160.00 -160.00 179.24 172.48 -173.91 . . 0 "[ . 1 . 2]"
106 . 1 6 ASP CA 1 6 ASP CB 1 6 ASP CG 1 6 ASP OD1 40.00 80.00 71.75 61.31 47.92 1.04 17 0 "[ . 1 . 2]"
107 . 1 8 ASP N 1 8 ASP CA 1 8 ASP CB 1 8 ASP CG 160.00 -160.00 -176.93 -179.68 178.97 0.97 16 0 "[ . 1 . 2]"
108 . 1 8 ASP CA 1 8 ASP CB 1 8 ASP CG 1 8 ASP OD1 40.00 80.00 65.53 75.86 71.15 1.45 17 0 "[ . 1 . 2]"
109 . 1 27 LEU N 1 27 LEU CA 1 27 LEU CB 1 27 LEU CG -100.40 -60.40 -72.86 -67.53 -69.88 1.92 11 0 "[ . 1 . 2]"
110 . 1 27 LEU CA 1 27 LEU CB 1 27 LEU CG 1 27 LEU CD1 152.70 -167.30 177.33 179.93 179.64 . . 0 "[ . 1 . 2]"
111 . 1 28 TYR N 1 28 TYR CA 1 28 TYR CB 1 28 TYR CG -96.00 -56.00 -66.07 -65.93 -70.19 . . 0 "[ . 1 . 2]"
112 . 1 28 TYR CA 1 28 TYR CB 1 28 TYR CG 1 28 TYR CD1 72.00 112.00 89.35 86.22 79.38 3.56 4 0 "[ . 1 . 2]"
113 . 1 31 LEU N 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG -178.40 -138.40 -175.96 -179.06 -173.03 0.66 15 0 "[ . 1 . 2]"
114 . 1 31 LEU CA 1 31 LEU CB 1 31 LEU CG 1 31 LEU CD1 53.00 93.00 59.77 54.83 63.76 . . 0 "[ . 1 . 2]"
115 . 1 37 ILE N 1 37 ILE CA 1 37 ILE CB 1 37 ILE CG1 -73.00 -33.00 -58.84 -64.38 -55.30 . . 0 "[ . 1 . 2]"
116 . 1 37 ILE CA 1 37 ILE CB 1 37 ILE CG1 1 37 ILE CD1 159.90 -160.10 -175.84 -176.73 -176.81 . . 0 "[ . 1 . 2]"
117 . 1 43 LYS N 1 43 LYS CA 1 43 LYS CB 1 43 LYS CG -119.30 -79.30 -76.02 -78.33 -79.08 5.43 19 4 "[ . 1 - * +*]"
118 . 1 43 LYS CA 1 43 LYS CB 1 43 LYS CG 1 43 LYS CD 162.30 -157.70 -176.43 174.52 -169.32 . . 0 "[ . 1 . 2]"
119 . 1 45 ARG CA 1 45 ARG CB 1 45 ARG CG 1 45 ARG CD 154.40 -165.60 175.18 -173.15 -179.59 . . 0 "[ . 1 . 2]"
120 . 1 49 LEU N 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG -82.70 -42.70 -49.13 -49.47 -50.07 . . 0 "[ . 1 . 2]"
121 . 1 49 LEU CA 1 49 LEU CB 1 49 LEU CG 1 49 LEU CD1 164.30 -155.70 -168.94 -175.87 -160.92 . . 0 "[ . 1 . 2]"
122 . 1 60 ARG N 1 60 ARG CA 1 60 ARG CB 1 60 ARG CG -70.80 -30.80 -57.44 -65.39 -53.11 . . 0 "[ . 1 . 2]"
123 . 1 60 ARG CA 1 60 ARG CB 1 60 ARG CG 1 60 ARG CD 160.30 -159.70 177.84 165.70 -170.87 . . 0 "[ . 1 . 2]"
124 . 1 62 GLN N 1 62 GLN CA 1 62 GLN CB 1 62 GLN CG -92.20 -52.20 -59.12 -55.33 -58.09 2.67 12 0 "[ . 1 . 2]"
125 . 1 62 GLN CA 1 62 GLN CB 1 62 GLN CG 1 62 GLN CD 44.00 84.00 79.38 89.84 85.34 5.84 2 1 "[ + . 1 . 2]"
126 . 1 65 ARG N 1 65 ARG CA 1 65 ARG CB 1 65 ARG CG -100.30 -60.30 -78.75 -76.41 -79.76 . . 0 "[ . 1 . 2]"
127 . 1 65 ARG CA 1 65 ARG CB 1 65 ARG CG 1 65 ARG CD 178.90 -141.10 -165.63 -163.04 -165.26 . . 0 "[ . 1 . 2]"
128 . 1 66 LYS N 1 66 LYS CA 1 66 LYS CB 1 66 LYS CG 40.00 80.00 46.05 44.53 42.55 0.55 8 0 "[ . 1 . 2]"
129 . 1 66 LYS CA 1 66 LYS CB 1 66 LYS CG 1 66 LYS CD 160.00 -160.00 -176.79 179.60 175.91 . . 0 "[ . 1 . 2]"
130 . 1 67 LEU N 1 67 LEU CA 1 67 LEU CB 1 67 LEU CG -77.00 -37.00 -55.87 -63.95 -48.53 . . 0 "[ . 1 . 2]"
131 . 1 67 LEU CA 1 67 LEU CB 1 67 LEU CG 1 67 LEU CD1 159.30 -160.70 175.89 174.43 174.03 . . 0 "[ . 1 . 2]"
132 . 1 68 ARG N 1 68 ARG CA 1 68 ARG CB 1 68 ARG CG -179.00 -139.00 -172.21 177.59 -163.08 3.41 10 0 "[ . 1 . 2]"
133 . 1 68 ARG CA 1 68 ARG CB 1 68 ARG CG 1 68 ARG CD 162.60 -157.40 174.59 175.17 172.28 . . 0 "[ . 1 . 2]"
134 . 1 69 LEU N 1 69 LEU CA 1 69 LEU CB 1 69 LEU CG -73.00 -33.00 -55.99 -63.24 -48.03 . . 0 "[ . 1 . 2]"
135 . 1 69 LEU CA 1 69 LEU CB 1 69 LEU CG 1 69 LEU CD1 161.90 -158.10 162.74 158.33 169.61 3.57 14 0 "[ . 1 . 2]"
136 . 1 70 LYS N 1 70 LYS CA 1 70 LYS CB 1 70 LYS CG -94.60 -54.60 -63.94 -72.99 -54.85 . . 0 "[ . 1 . 2]"
137 . 1 70 LYS CA 1 70 LYS CB 1 70 LYS CG 1 70 LYS CD -170.80 -130.80 -171.05 -174.60 -175.50 5.53 1 1 "[+ . 1 . 2]"
138 . 1 72 LYS N 1 72 LYS CA 1 72 LYS CB 1 72 LYS CG -91.60 -51.60 -63.50 -78.82 -48.18 3.42 6 0 "[ . 1 . 2]"
139 . 1 72 LYS CA 1 72 LYS CB 1 72 LYS CG 1 72 LYS CD -109.20 -69.20 -70.16 -89.00 -63.18 6.02 3 1 "[ + . 1 . 2]"
140 . 1 74 PHE N 1 74 PHE CA 1 74 PHE CB 1 74 PHE CG -125.20 -85.20 -107.94 -130.26 -84.50 5.06 13 1 "[ . 1 + . 2]"
141 . 1 74 PHE CA 1 74 PHE CB 1 74 PHE CG 1 74 PHE CD1 33.40 73.40 64.95 62.85 58.02 3.59 7 0 "[ . 1 . 2]"
142 . 1 80 ARG N 1 80 ARG CA 1 80 ARG CB 1 80 ARG CG -153.60 -93.60 -94.28 -158.84 -86.00 7.60 12 9 "[* *.* *** + - *]"
143 . 1 80 ARG CA 1 80 ARG CB 1 80 ARG CG 1 80 ARG CD 175.80 -144.20 -168.33 178.66 -143.57 0.63 9 0 "[ . 1 . 2]"
144 . 1 83 LEU N 1 83 LEU CA 1 83 LEU CB 1 83 LEU CG 171.00 -149.00 173.38 176.30 175.43 1.72 7 0 "[ . 1 . 2]"
145 . 1 83 LEU CA 1 83 LEU CB 1 83 LEU CG 1 83 LEU CD1 40.00 80.00 58.41 55.28 61.57 . . 0 "[ . 1 . 2]"
146 . 1 84 TYR N 1 84 TYR CA 1 84 TYR CB 1 84 TYR CG 160.00 -160.00 -165.96 -177.40 -157.53 2.47 6 0 "[ . 1 . 2]"
147 . 1 84 TYR CA 1 84 TYR CB 1 84 TYR CG 1 84 TYR CD1 40.00 90.00 65.62 39.22 84.34 0.78 20 0 "[ . 1 . 2]"
148 . 1 85 LEU N 1 85 LEU CA 1 85 LEU CB 1 85 LEU CG -114.90 -74.90 -72.69 -74.07 -71.59 3.31 5 0 "[ . 1 . 2]"
149 . 1 85 LEU CA 1 85 LEU CB 1 85 LEU CG 1 85 LEU CD1 130.90 -169.10 178.25 179.28 178.67 . . 0 "[ . 1 . 2]"
150 . 1 88 ARG N 1 88 ARG CA 1 88 ARG CB 1 88 ARG CG -69.60 -29.60 -59.75 -70.54 -48.66 0.94 9 0 "[ . 1 . 2]"
151 . 1 88 ARG CA 1 88 ARG CB 1 88 ARG CG 1 88 ARG CD -75.10 -35.10 -59.34 -70.05 -47.06 . . 0 "[ . 1 . 2]"
152 . 1 89 ILE N 1 89 ILE CA 1 89 ILE CB 1 89 ILE CG1 -90.20 -50.20 -67.97 -73.55 -63.50 . . 0 "[ . 1 . 2]"
153 . 1 89 ILE CA 1 89 ILE CB 1 89 ILE CG1 1 89 ILE CD1 163.70 -156.30 -175.68 -179.50 -172.82 . . 0 "[ . 1 . 2]"
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