NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
470486 |
2al3   |
6761 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2al3
save_distance_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 147
_TA_constraint_stats_list.Viol_count 1154
_TA_constraint_stats_list.Viol_total 17359.90
_TA_constraint_stats_list.Viol_max 15.92
_TA_constraint_stats_list.Viol_rms 0.82
_TA_constraint_stats_list.Viol_average_all_restraints 0.30
_TA_constraint_stats_list.Viol_average_violations_only 0.75
_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 CHI1 1 13 SER N 1 13 SER CA 1 13 SER CB 1 13 SER OG 160.00 -160.00 -172.31 -159.71 -163.41 0.96 10 0 "[ . 1 . 2]"
2 CHI1 1 15 LEU N 1 15 LEU CA 1 15 LEU CB 1 15 LEU CG 40.00 80.00 83.73 81.37 95.92 15.92 19 2 "[ . 1 - . +2]"
3 CHI1 1 18 ASN N 1 18 ASN CA 1 18 ASN CB 1 18 ASN CG 40.00 80.00 60.93 36.44 74.49 3.56 5 0 "[ . 1 . 2]"
4 CHI1 1 22 HIS N 1 22 HIS CA 1 22 HIS CB 1 22 HIS CG 40.00 80.00 65.87 68.74 67.21 . . 0 "[ . 1 . 2]"
5 CHI1 1 25 LYS N 1 25 LYS CA 1 25 LYS CB 1 25 LYS CG 40.00 80.00 60.09 57.12 56.50 . . 0 "[ . 1 . 2]"
6 CHI1 1 29 SER N 1 29 SER CA 1 29 SER CB 1 29 SER OG 40.00 80.00 50.25 40.33 77.44 . . 0 "[ . 1 . 2]"
7 CHI1 1 34 GLN N 1 34 GLN CA 1 34 GLN CB 1 34 GLN CG 40.00 80.00 79.98 84.93 84.68 4.93 2 0 "[ . 1 . 2]"
8 CHI1 1 36 LEU N 1 36 LEU CA 1 36 LEU CB 1 36 LEU CG 160.00 -160.00 -177.30 170.62 -158.09 1.91 20 0 "[ . 1 . 2]"
9 CHI1 1 40 CYS N 1 40 CYS CA 1 40 CYS CB 1 40 CYS SG -80.00 -40.00 -82.34 -84.20 -80.62 4.20 14 0 "[ . 1 . 2]"
10 CHI1 1 41 ARG N 1 41 ARG CA 1 41 ARG CB 1 41 ARG CG 10.00 110.00 111.80 110.99 110.71 9.03 8 3 "[ . + * .- 2]"
11 CHI1 1 43 GLN N 1 43 GLN CA 1 43 GLN CB 1 43 GLN CG 30.00 90.00 92.72 89.77 88.53 5.56 15 3 "[ . - 1 + * 2]"
12 CHI1 1 44 ASP N 1 44 ASP CA 1 44 ASP CB 1 44 ASP CG 40.00 80.00 50.39 54.96 51.97 . . 0 "[ . 1 . 2]"
13 CHI1 1 45 PHE N 1 45 PHE CA 1 45 PHE CB 1 45 PHE CG -100.00 -20.00 -102.47 -102.92 -103.21 3.75 11 0 "[ . 1 . 2]"
14 CHI1 1 49 GLU N 1 49 GLU CA 1 49 GLU CB 1 49 GLU CG -80.00 -40.00 -68.79 -74.65 -62.70 . . 0 "[ . 1 . 2]"
15 CHI1 1 50 TYR N 1 50 TYR CA 1 50 TYR CB 1 50 TYR CG -80.00 -40.00 -72.15 -73.63 -69.76 . . 0 "[ . 1 . 2]"
16 CHI1 1 51 ASP N 1 51 ASP CA 1 51 ASP CB 1 51 ASP CG -90.00 -30.00 -91.23 -93.06 -93.67 3.67 1 0 "[ . 1 . 2]"
17 CHI1 1 52 LEU N 1 52 LEU CA 1 52 LEU CB 1 52 LEU CG -80.00 -40.00 -46.23 -56.72 -39.21 0.79 1 0 "[ . 1 . 2]"
18 CHI1 1 53 LYS N 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG 160.00 -160.00 175.95 158.09 -172.13 1.91 6 0 "[ . 1 . 2]"
19 CHI1 1 56 ARG N 1 56 ARG CA 1 56 ARG CB 1 56 ARG CG -80.00 -40.00 -73.54 -79.41 -64.59 . . 0 "[ . 1 . 2]"
20 CHI1 1 59 LEU N 1 59 LEU CA 1 59 LEU CB 1 59 LEU CG -80.00 -40.00 -79.70 -81.35 -76.62 1.35 3 0 "[ . 1 . 2]"
21 CHI1 1 60 ASP N 1 60 ASP CA 1 60 ASP CB 1 60 ASP CG 150.00 -150.00 -148.84 -149.51 -148.01 1.99 1 0 "[ . 1 . 2]"
22 CHI1 1 61 LEU N 1 61 LEU CA 1 61 LEU CB 1 61 LEU CG -80.00 -40.00 -55.01 -51.35 -56.76 2.18 14 0 "[ . 1 . 2]"
23 CHI1 1 62 SER N 1 62 SER CA 1 62 SER CB 1 62 SER OG 40.00 80.00 60.82 43.03 76.59 . . 0 "[ . 1 . 2]"
24 CHI1 1 63 LEU N 1 63 LEU CA 1 63 LEU CB 1 63 LEU CG -80.00 -40.00 -63.57 -58.05 -66.59 0.22 15 0 "[ . 1 . 2]"
25 CHI1 1 64 GLN N 1 64 GLN CA 1 64 GLN CB 1 64 GLN CG -80.00 -40.00 -57.07 -51.67 -54.93 . . 0 "[ . 1 . 2]"
26 CHI1 1 65 TRP N 1 65 TRP CA 1 65 TRP CB 1 65 TRP CG 160.00 -160.00 173.84 166.58 178.63 . . 0 "[ . 1 . 2]"
27 CHI1 1 67 PHE N 1 67 PHE CA 1 67 PHE CB 1 67 PHE CG -80.00 -40.00 -81.51 -82.98 -83.96 5.90 17 2 "[ . 1 - + 2]"
28 CHI1 1 69 ASN N 1 69 ASN CA 1 69 ASN CB 1 69 ASN CG 40.00 80.00 54.46 56.65 55.88 . . 0 "[ . 1 . 2]"
29 CHI1 1 70 LEU N 1 70 LEU CA 1 70 LEU CB 1 70 LEU CG -80.00 -40.00 -60.02 -64.36 -72.65 4.79 17 0 "[ . 1 . 2]"
30 CHI1 1 72 ASN N 1 72 ASN CA 1 72 ASN CB 1 72 ASN CG 30.00 90.00 28.63 28.31 28.21 2.01 3 0 "[ . 1 . 2]"
31 CHI1 1 76 LEU N 1 76 LEU CA 1 76 LEU CB 1 76 LEU CG -90.00 -30.00 -28.11 -33.50 -21.59 8.41 19 2 "[ .- 1 . +2]"
32 CHI1 1 32 LEU N 1 32 LEU CA 1 32 LEU CB 1 32 LEU CG -80.00 -40.00 -72.57 -74.94 -78.62 0.15 20 0 "[ . 1 . 2]"
33 CHI1 1 33 LEU N 1 33 LEU CA 1 33 LEU CB 1 33 LEU CG 40.00 80.00 72.06 80.01 71.65 2.13 16 0 "[ . 1 . 2]"
34 PSI 1 10 SER N 1 10 SER CA 1 10 SER C 1 11 ALA N 123.60 173.30 146.57 123.50 167.04 0.10 2 0 "[ . 1 . 2]"
35 PHI 1 10 SER C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -147.20 -101.80 -146.43 -147.31 -142.37 0.11 17 0 "[ . 1 . 2]"
36 PSI 1 11 ALA N 1 11 ALA CA 1 11 ALA C 1 12 VAL N 140.20 165.90 143.90 146.71 145.69 0.14 17 0 "[ . 1 . 2]"
37 PHI 1 11 ALA C 1 12 VAL N 1 12 VAL CA 1 12 VAL C -146.80 -119.00 -118.96 -118.76 -118.79 0.43 12 0 "[ . 1 . 2]"
38 PSI 1 12 VAL N 1 12 VAL CA 1 12 VAL C 1 13 SER N 131.60 162.10 139.65 131.51 149.39 0.09 18 0 "[ . 1 . 2]"
39 PHI 1 12 VAL C 1 13 SER N 1 13 SER CA 1 13 SER C -137.40 -102.00 -127.80 -125.47 -127.36 0.09 14 0 "[ . 1 . 2]"
40 PSI 1 13 SER N 1 13 SER CA 1 13 SER C 1 14 VAL N 124.40 148.70 132.92 127.18 137.63 . . 0 "[ . 1 . 2]"
41 PHI 1 13 SER C 1 14 VAL N 1 14 VAL CA 1 14 VAL C -138.00 -120.10 -119.73 -119.82 -119.83 0.63 20 0 "[ . 1 . 2]"
42 PSI 1 14 VAL N 1 14 VAL CA 1 14 VAL C 1 15 LEU N 117.70 141.30 117.40 117.10 117.71 0.60 9 0 "[ . 1 . 2]"
43 PHI 1 14 VAL C 1 15 LEU N 1 15 LEU CA 1 15 LEU C -134.40 -91.60 -104.62 -108.43 -101.59 . . 0 "[ . 1 . 2]"
44 PSI 1 15 LEU N 1 15 LEU CA 1 15 LEU C 1 16 ALA N 109.80 124.20 114.54 109.70 109.66 0.27 16 0 "[ . 1 . 2]"
45 PHI 1 15 LEU C 1 16 ALA N 1 16 ALA CA 1 16 ALA C -120.30 -80.20 -84.39 -81.71 -82.54 . . 0 "[ . 1 . 2]"
46 PSI 1 16 ALA N 1 16 ALA CA 1 16 ALA C 1 17 PRO N 92.40 138.20 133.14 131.70 131.52 . . 0 "[ . 1 . 2]"
47 PSI 1 17 PRO N 1 17 PRO CA 1 17 PRO C 1 18 ASN N -60.10 -8.90 -8.25 -8.01 -8.07 1.34 16 0 "[ . 1 . 2]"
48 PHI 1 17 PRO C 1 18 ASN N 1 18 ASN CA 1 18 ASN C -96.00 -80.10 -79.79 -80.11 -79.17 0.93 16 0 "[ . 1 . 2]"
49 PSI 1 18 ASN N 1 18 ASN CA 1 18 ASN C 1 19 GLY N -5.90 15.50 3.00 2.75 2.46 . . 0 "[ . 1 . 2]"
50 PHI 1 18 ASN C 1 19 GLY N 1 19 GLY CA 1 19 GLY C 74.60 100.20 95.51 90.87 99.36 . . 0 "[ . 1 . 2]"
51 PSI 1 19 GLY N 1 19 GLY CA 1 19 GLY C 1 20 ARG N -9.00 14.00 15.86 15.87 15.85 2.13 19 0 "[ . 1 . 2]"
52 PHI 1 19 GLY C 1 20 ARG N 1 20 ARG CA 1 20 ARG C -116.20 -66.10 -113.45 -116.22 -110.30 0.02 16 0 "[ . 1 . 2]"
53 PSI 1 20 ARG N 1 20 ARG CA 1 20 ARG C 1 21 ARG N 114.60 161.10 114.33 114.49 114.44 0.43 9 0 "[ . 1 . 2]"
54 PHI 1 20 ARG C 1 21 ARG N 1 21 ARG CA 1 21 ARG C -109.40 -86.60 -110.32 -110.34 -110.35 1.15 17 0 "[ . 1 . 2]"
55 PSI 1 21 ARG N 1 21 ARG CA 1 21 ARG C 1 22 HIS N 116.20 129.60 118.31 116.15 116.11 0.38 15 0 "[ . 1 . 2]"
56 PHI 1 21 ARG C 1 22 HIS N 1 22 HIS CA 1 22 HIS C -139.10 -104.30 -139.08 -139.36 -137.97 0.26 15 0 "[ . 1 . 2]"
57 PSI 1 22 HIS N 1 22 HIS CA 1 22 HIS C 1 23 THR N 120.00 138.60 137.80 138.78 138.68 0.24 2 0 "[ . 1 . 2]"
58 PHI 1 22 HIS C 1 23 THR N 1 23 THR CA 1 23 THR C -118.50 -85.40 -118.73 -118.02 -118.65 0.39 11 0 "[ . 1 . 2]"
59 PSI 1 23 THR N 1 23 THR CA 1 23 THR C 1 24 VAL N 118.10 135.70 130.23 124.91 134.37 . . 0 "[ . 1 . 2]"
60 PHI 1 23 THR C 1 24 VAL N 1 24 VAL CA 1 24 VAL C -120.20 -103.20 -120.47 -120.41 -120.44 0.41 4 0 "[ . 1 . 2]"
61 PSI 1 24 VAL N 1 24 VAL CA 1 24 VAL C 1 25 LYS N 123.60 140.20 128.80 126.81 126.39 0.23 9 0 "[ . 1 . 2]"
62 PHI 1 24 VAL C 1 25 LYS N 1 25 LYS CA 1 25 LYS C -115.00 -77.00 -86.59 -103.30 -76.83 0.17 14 0 "[ . 1 . 2]"
63 PSI 1 25 LYS N 1 25 LYS CA 1 25 LYS C 1 26 VAL N 107.20 155.80 117.20 121.19 119.18 . . 0 "[ . 1 . 2]"
64 PHI 1 25 LYS C 1 26 VAL N 1 26 VAL CA 1 26 VAL C -150.20 -105.50 -121.37 -136.71 -106.70 . . 0 "[ . 1 . 2]"
65 PSI 1 26 VAL N 1 26 VAL CA 1 26 VAL C 1 27 THR N 153.30 168.40 168.34 168.50 168.48 0.18 9 0 "[ . 1 . 2]"
66 PHI 1 26 VAL C 1 27 THR N 1 27 THR CA 1 27 THR C -116.20 -78.60 -91.37 -86.52 -89.51 . . 0 "[ . 1 . 2]"
67 PSI 1 27 THR N 1 27 THR CA 1 27 THR C 1 28 PRO N 112.30 153.70 154.23 153.61 154.58 0.88 17 0 "[ . 1 . 2]"
68 PSI 1 28 PRO N 1 28 PRO CA 1 28 PRO C 1 29 SER N -30.60 -12.40 -12.43 -13.68 -12.17 0.23 10 0 "[ . 1 . 2]"
69 PHI 1 28 PRO C 1 29 SER N 1 29 SER CA 1 29 SER C -115.20 -86.60 -109.34 -108.99 -109.60 . . 0 "[ . 1 . 2]"
70 PSI 1 29 SER N 1 29 SER CA 1 29 SER C 1 30 THR N -13.90 13.60 -3.50 -6.32 1.36 . . 0 "[ . 1 . 2]"
71 PHI 1 29 SER C 1 30 THR N 1 30 THR CA 1 30 THR C -88.70 -63.20 -88.56 -88.07 -88.38 0.13 9 0 "[ . 1 . 2]"
72 PSI 1 30 THR N 1 30 THR CA 1 30 THR C 1 31 VAL N 119.50 140.00 140.11 139.18 140.43 0.43 19 0 "[ . 1 . 2]"
73 PHI 1 30 THR C 1 31 VAL N 1 31 VAL CA 1 31 VAL C -114.00 -77.50 -77.38 -77.98 -77.08 0.42 5 0 "[ . 1 . 2]"
74 PSI 1 31 VAL N 1 31 VAL CA 1 31 VAL C 1 32 LEU N 101.40 168.50 131.49 132.06 130.43 . . 0 "[ . 1 . 2]"
75 PHI 1 31 VAL C 1 32 LEU N 1 32 LEU CA 1 32 LEU C -72.30 -57.00 -58.88 -57.08 -57.35 0.30 5 0 "[ . 1 . 2]"
76 PSI 1 32 LEU N 1 32 LEU CA 1 32 LEU C 1 33 LEU N -40.00 -21.60 -21.35 -21.28 -21.30 0.52 7 0 "[ . 1 . 2]"
77 PHI 1 32 LEU C 1 33 LEU N 1 33 LEU CA 1 33 LEU C -67.10 -56.90 -62.83 -62.88 -63.02 . . 0 "[ . 1 . 2]"
78 PSI 1 33 LEU N 1 33 LEU CA 1 33 LEU C 1 34 GLN N -47.40 -37.80 -44.71 -44.84 -45.15 . . 0 "[ . 1 . 2]"
79 PHI 1 33 LEU C 1 34 GLN N 1 34 GLN CA 1 34 GLN C -67.60 -60.50 -67.62 -67.23 -67.38 0.29 5 0 "[ . 1 . 2]"
80 PSI 1 34 GLN N 1 34 GLN CA 1 34 GLN C 1 35 VAL N -44.60 -33.00 -38.91 -40.74 -37.25 . . 0 "[ . 1 . 2]"
81 PHI 1 34 GLN C 1 35 VAL N 1 35 VAL CA 1 35 VAL C -71.90 -64.20 -72.24 -72.07 -72.08 0.58 14 0 "[ . 1 . 2]"
82 PSI 1 35 VAL N 1 35 VAL CA 1 35 VAL C 1 36 LEU N -50.30 -38.70 -49.26 -49.48 -49.81 . . 0 "[ . 1 . 2]"
83 PHI 1 35 VAL C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -64.40 -58.70 -60.59 -60.93 -61.29 0.18 9 0 "[ . 1 . 2]"
84 PSI 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 GLU N -46.70 -37.10 -41.94 -46.76 -37.60 0.06 10 0 "[ . 1 . 2]"
85 PHI 1 36 LEU C 1 37 GLU N 1 37 GLU CA 1 37 GLU C -67.00 -60.80 -65.42 -64.99 -65.43 0.20 20 0 "[ . 1 . 2]"
86 PSI 1 37 GLU N 1 37 GLU CA 1 37 GLU C 1 38 ASP N -44.80 -37.60 -41.53 -44.44 -38.15 . . 0 "[ . 1 . 2]"
87 PHI 1 37 GLU C 1 38 ASP N 1 38 ASP CA 1 38 ASP C -71.60 -59.60 -62.29 -63.81 -64.50 . . 0 "[ . 1 . 2]"
88 PSI 1 38 ASP N 1 38 ASP CA 1 38 ASP C 1 39 THR N -53.90 -34.60 -54.23 -54.18 -54.21 0.56 20 0 "[ . 1 . 2]"
89 PHI 1 38 ASP C 1 39 THR N 1 39 THR CA 1 39 THR C -74.30 -55.00 -61.60 -62.72 -62.72 . . 0 "[ . 1 . 2]"
90 PSI 1 39 THR N 1 39 THR CA 1 39 THR C 1 40 CYS N -53.20 -34.60 -34.98 -37.91 -34.07 0.53 11 0 "[ . 1 . 2]"
91 PHI 1 39 THR C 1 40 CYS N 1 40 CYS CA 1 40 CYS C -67.90 -56.50 -68.11 -68.34 -67.49 0.44 2 0 "[ . 1 . 2]"
92 PSI 1 40 CYS N 1 40 CYS CA 1 40 CYS C 1 41 ARG N -46.70 -37.00 -36.55 -36.59 -36.61 0.65 8 0 "[ . 1 . 2]"
93 PHI 1 40 CYS C 1 41 ARG N 1 41 ARG CA 1 41 ARG C -67.90 -57.60 -67.17 -68.04 -64.71 0.14 4 0 "[ . 1 . 2]"
94 PSI 1 41 ARG N 1 41 ARG CA 1 41 ARG C 1 42 ARG N -48.40 -35.10 -48.76 -48.99 -48.41 0.59 6 0 "[ . 1 . 2]"
95 PHI 1 41 ARG C 1 42 ARG N 1 42 ARG CA 1 42 ARG C -74.80 -58.80 -74.77 -75.21 -72.74 0.41 2 0 "[ . 1 . 2]"
96 PSI 1 42 ARG N 1 42 ARG CA 1 42 ARG C 1 43 GLN N -37.20 -17.40 -37.22 -37.46 -36.26 0.26 6 0 "[ . 1 . 2]"
97 PHI 1 42 ARG C 1 43 GLN N 1 43 GLN CA 1 43 GLN C -104.80 -86.70 -93.43 -92.38 -93.20 . . 0 "[ . 1 . 2]"
98 PSI 1 43 GLN N 1 43 GLN CA 1 43 GLN C 1 44 ASP N -4.20 13.10 8.12 2.22 13.36 0.26 20 0 "[ . 1 . 2]"
99 PHI 1 44 ASP C 1 45 PHE N 1 45 PHE CA 1 45 PHE C -134.20 -111.40 -127.87 -128.44 -129.18 . . 0 "[ . 1 . 2]"
100 PSI 1 45 PHE N 1 45 PHE CA 1 45 PHE C 1 46 ASN N 132.30 159.20 159.31 159.35 159.31 0.27 20 0 "[ . 1 . 2]"
101 PHI 1 45 PHE C 1 46 ASN N 1 46 ASN CA 1 46 ASN C -131.90 -93.00 -122.39 -121.86 -122.25 . . 0 "[ . 1 . 2]"
102 PSI 1 46 ASN N 1 46 ASN CA 1 46 ASN C 1 47 PRO N 106.50 147.10 143.64 141.00 145.41 . . 0 "[ . 1 . 2]"
103 PSI 1 47 PRO N 1 47 PRO CA 1 47 PRO C 1 48 SER N -58.90 1.40 -35.40 -36.52 -34.21 . . 0 "[ . 1 . 2]"
104 PHI 1 47 PRO C 1 48 SER N 1 48 SER CA 1 48 SER C -79.10 -56.30 -65.00 -66.47 -62.24 . . 0 "[ . 1 . 2]"
105 PSI 1 48 SER N 1 48 SER CA 1 48 SER C 1 49 GLU N -41.10 -9.20 -8.50 -8.69 -8.33 0.87 4 0 "[ . 1 . 2]"
106 PHI 1 48 SER C 1 49 GLU N 1 49 GLU CA 1 49 GLU C -123.50 -61.10 -123.67 -123.89 -123.98 0.50 1 0 "[ . 1 . 2]"
107 PSI 1 49 GLU N 1 49 GLU CA 1 49 GLU C 1 50 TYR N -54.60 16.70 -1.22 -1.39 -1.78 . . 0 "[ . 1 . 2]"
108 PHI 1 49 GLU C 1 50 TYR N 1 50 TYR CA 1 50 TYR C -157.70 -96.60 -144.90 -147.47 -140.03 . . 0 "[ . 1 . 2]"
109 PSI 1 50 TYR N 1 50 TYR CA 1 50 TYR C 1 51 ASP N 140.40 166.40 139.41 139.17 139.63 1.23 3 0 "[ . 1 . 2]"
110 PHI 1 50 TYR C 1 51 ASP N 1 51 ASP CA 1 51 ASP C -130.20 -99.60 -131.35 -131.58 -131.17 1.38 3 0 "[ . 1 . 2]"
111 PSI 1 51 ASP N 1 51 ASP CA 1 51 ASP C 1 52 LEU N 134.00 146.10 147.48 147.23 147.74 1.64 19 0 "[ . 1 . 2]"
112 PHI 1 51 ASP C 1 52 LEU N 1 52 LEU CA 1 52 LEU C -154.80 -122.80 -121.63 -121.87 -121.37 1.43 5 0 "[ . 1 . 2]"
113 PSI 1 52 LEU N 1 52 LEU CA 1 52 LEU C 1 53 LYS N 134.00 161.00 134.83 136.29 136.10 0.20 17 0 "[ . 1 . 2]"
114 PHI 1 52 LEU C 1 53 LYS N 1 53 LYS CA 1 53 LYS C -148.90 -111.60 -148.18 -149.13 -146.57 0.23 11 0 "[ . 1 . 2]"
115 PSI 1 53 LYS N 1 53 LYS CA 1 53 LYS C 1 54 PHE N 127.50 143.10 141.38 138.73 137.42 0.16 16 0 "[ . 1 . 2]"
116 PHI 1 53 LYS C 1 54 PHE N 1 54 PHE CA 1 54 PHE C -147.50 -114.50 -128.04 -126.03 -127.63 . . 0 "[ . 1 . 2]"
117 PSI 1 54 PHE N 1 54 PHE CA 1 54 PHE C 1 55 GLN N 113.90 141.90 113.76 113.79 113.76 0.26 20 0 "[ . 1 . 2]"
118 PHI 1 55 GLN C 1 56 ARG N 1 56 ARG CA 1 56 ARG C -110.40 -60.20 -110.68 -110.88 -110.55 0.48 3 0 "[ . 1 . 2]"
119 PSI 1 56 ARG N 1 56 ARG CA 1 56 ARG C 1 57 THR N -23.30 14.80 14.78 14.34 14.98 0.18 3 0 "[ . 1 . 2]"
120 PHI 1 56 ARG C 1 57 THR N 1 57 THR CA 1 57 THR C -121.50 -84.20 -119.44 -119.15 -119.58 . . 0 "[ . 1 . 2]"
121 PSI 1 57 THR N 1 57 THR CA 1 57 THR C 1 58 VAL N 115.50 140.60 128.60 130.54 128.19 . . 0 "[ . 1 . 2]"
122 PHI 1 57 THR C 1 58 VAL N 1 58 VAL CA 1 58 VAL C -119.50 -61.30 -86.91 -94.50 -81.79 . . 0 "[ . 1 . 2]"
123 PSI 1 58 VAL N 1 58 VAL CA 1 58 VAL C 1 59 LEU N 119.70 140.30 140.51 140.56 140.49 0.41 20 0 "[ . 1 . 2]"
124 PHI 1 60 ASP C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -90.10 -58.30 -90.21 -90.43 -89.89 0.33 19 0 "[ . 1 . 2]"
125 PSI 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 SER N -42.70 11.00 -37.33 -42.77 10.60 0.07 19 0 "[ . 1 . 2]"
126 PHI 1 63 LEU C 1 64 GLN N 1 64 GLN CA 1 64 GLN C -94.10 -70.70 -91.70 -94.22 -82.83 0.12 17 0 "[ . 1 . 2]"
127 PSI 1 64 GLN N 1 64 GLN CA 1 64 GLN C 1 65 TRP N 141.00 169.50 150.20 153.73 150.91 . . 0 "[ . 1 . 2]"
128 PHI 1 64 GLN C 1 65 TRP N 1 65 TRP CA 1 65 TRP C -63.30 -53.90 -63.23 -63.45 -63.51 0.21 1 0 "[ . 1 . 2]"
129 PSI 1 65 TRP N 1 65 TRP CA 1 65 TRP C 1 66 ARG N -45.60 -26.50 -41.36 -39.32 -39.85 . . 0 "[ . 1 . 2]"
130 PHI 1 65 TRP C 1 66 ARG N 1 66 ARG CA 1 66 ARG C -79.70 -56.30 -57.39 -56.34 -56.62 0.21 16 0 "[ . 1 . 2]"
131 PSI 1 66 ARG N 1 66 ARG CA 1 66 ARG C 1 67 PHE N -36.10 -6.30 -16.87 -27.99 -7.89 . . 0 "[ . 1 . 2]"
132 PHI 1 69 ASN C 1 70 LEU N 1 70 LEU CA 1 70 LEU C -145.50 -85.60 -95.85 -104.93 -85.99 . . 0 "[ . 1 . 2]"
133 PSI 1 70 LEU N 1 70 LEU CA 1 70 LEU C 1 71 PRO N 126.60 170.70 160.33 157.40 165.66 . . 0 "[ . 1 . 2]"
134 PSI 1 71 PRO N 1 71 PRO CA 1 71 PRO C 1 72 ASN N 122.70 172.30 172.45 172.60 172.55 0.30 2 0 "[ . 1 . 2]"
135 PHI 1 72 ASN C 1 73 ASN N 1 73 ASN CA 1 73 ASN C -86.80 -57.50 -64.35 -63.88 -64.12 . . 0 "[ . 1 . 2]"
136 PSI 1 73 ASN N 1 73 ASN CA 1 73 ASN C 1 74 ALA N -48.20 -2.10 -1.95 -2.75 -1.71 0.39 1 0 "[ . 1 . 2]"
137 PHI 1 74 ALA C 1 75 LYS N 1 75 LYS CA 1 75 LYS C -115.60 -79.00 -91.10 -85.94 -88.40 . . 0 "[ . 1 . 2]"
138 PSI 1 75 LYS N 1 75 LYS CA 1 75 LYS C 1 76 LEU N 101.30 140.50 121.20 122.18 121.34 . . 0 "[ . 1 . 2]"
139 PHI 1 75 LYS C 1 76 LEU N 1 76 LEU CA 1 76 LEU C -122.00 -91.90 -117.48 -122.13 -111.75 0.13 9 0 "[ . 1 . 2]"
140 PSI 1 76 LEU N 1 76 LEU CA 1 76 LEU C 1 77 GLU N 123.00 153.80 152.75 153.12 152.37 0.32 20 0 "[ . 1 . 2]"
141 PHI 1 76 LEU C 1 77 GLU N 1 77 GLU CA 1 77 GLU C -145.70 -101.50 -102.60 -106.87 -101.33 0.17 14 0 "[ . 1 . 2]"
142 PSI 1 77 GLU N 1 77 GLU CA 1 77 GLU C 1 78 MET N 125.50 157.30 133.00 141.23 135.89 . . 0 "[ . 1 . 2]"
143 PHI 1 77 GLU C 1 78 MET N 1 78 MET CA 1 78 MET C -132.00 -85.30 -89.07 -99.23 -85.34 . . 0 "[ . 1 . 2]"
144 PSI 1 78 MET N 1 78 MET CA 1 78 MET C 1 79 VAL N 123.40 151.60 133.71 134.47 134.02 . . 0 "[ . 1 . 2]"
145 PHI 1 78 MET C 1 79 VAL N 1 79 VAL CA 1 79 VAL C -145.90 -110.70 -145.73 -145.88 -145.98 0.29 18 0 "[ . 1 . 2]"
146 PSI 1 79 VAL N 1 79 VAL CA 1 79 VAL C 1 80 PRO N 122.10 155.20 136.24 135.42 134.90 . . 0 "[ . 1 . 2]"
147 PSI 1 80 PRO N 1 80 PRO CA 1 80 PRO C 1 81 VAL N 133.60 153.00 133.00 133.07 133.05 0.78 13 0 "[ . 1 . 2]"
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