NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
575167 |
2mmz   |
19872 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mmz
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 183
_TA_constraint_stats_list.Viol_count 304
_TA_constraint_stats_list.Viol_total 19593.75
_TA_constraint_stats_list.Viol_max 15.42
_TA_constraint_stats_list.Viol_rms 1.31
_TA_constraint_stats_list.Viol_average_all_restraints 0.27
_TA_constraint_stats_list.Viol_average_violations_only 3.22
_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 PHI 1 12 SER C 1 13 ALA N 1 13 ALA CA 1 13 ALA C -77.80 -37.80 -56.81 -62.47 -52.01 . . 0 "[ . 1 . 2]"
2 PSI 1 13 ALA N 1 13 ALA CA 1 13 ALA C 1 14 GLU N -57.80 -17.80 -34.15 -37.65 -39.61 . . 0 "[ . 1 . 2]"
3 PHI 1 13 ALA C 1 14 GLU N 1 14 GLU CA 1 14 GLU C -83.20 -43.20 -66.60 -73.90 -58.70 . . 0 "[ . 1 . 2]"
4 PSI 1 14 GLU N 1 14 GLU CA 1 14 GLU C 1 15 GLN N -63.30 -23.30 -24.03 -23.98 -24.51 2.02 3 0 "[ . 1 . 2]"
5 PHI 1 14 GLU C 1 15 GLN N 1 15 GLN CA 1 15 GLN C -86.90 -46.90 -79.54 -79.32 -80.03 1.63 10 0 "[ . 1 . 2]"
6 PSI 1 15 GLN N 1 15 GLN CA 1 15 GLN C 1 16 LEU N -59.30 -19.30 -50.40 -48.74 -48.86 . . 0 "[ . 1 . 2]"
7 PHI 1 15 GLN C 1 16 LEU N 1 16 LEU CA 1 16 LEU C -86.80 -46.80 -57.64 -61.39 -49.83 . . 0 "[ . 1 . 2]"
8 PSI 1 16 LEU N 1 16 LEU CA 1 16 LEU C 1 17 ASP N -54.30 -14.30 -33.72 -32.64 -33.13 . . 0 "[ . 1 . 2]"
9 PHI 1 16 LEU C 1 17 ASP N 1 17 ASP CA 1 17 ASP C -82.60 -42.60 -61.94 -69.23 -54.83 . . 0 "[ . 1 . 2]"
10 PSI 1 17 ASP N 1 17 ASP CA 1 17 ASP C 1 18 ALA N -63.50 -23.50 -43.97 -45.45 -46.39 . . 0 "[ . 1 . 2]"
11 PHI 1 17 ASP C 1 18 ALA N 1 18 ALA CA 1 18 ALA C -81.60 -41.60 -70.33 -80.53 -61.30 . . 0 "[ . 1 . 2]"
12 PSI 1 18 ALA N 1 18 ALA CA 1 18 ALA C 1 19 LEU N -56.70 -16.70 -29.68 -29.90 -30.21 . . 0 "[ . 1 . 2]"
13 PHI 1 18 ALA C 1 19 LEU N 1 19 LEU CA 1 19 LEU C -84.00 -44.00 -68.02 -79.32 -61.19 . . 0 "[ . 1 . 2]"
14 PSI 1 19 LEU N 1 19 LEU CA 1 19 LEU C 1 20 VAL N -58.80 -18.80 -46.14 -50.82 -33.84 . . 0 "[ . 1 . 2]"
15 PHI 1 19 LEU C 1 20 VAL N 1 20 VAL CA 1 20 VAL C -95.80 -43.20 -68.52 -67.13 -68.40 . . 0 "[ . 1 . 2]"
16 PSI 1 20 VAL N 1 20 VAL CA 1 20 VAL C 1 21 LYS N -52.60 -7.70 -21.25 -31.83 -13.89 . . 0 "[ . 1 . 2]"
17 PHI 1 20 VAL C 1 21 LYS N 1 21 LYS CA 1 21 LYS C -126.50 -36.10 -86.34 -88.50 -89.33 . . 0 "[ . 1 . 2]"
18 PSI 1 21 LYS N 1 21 LYS CA 1 21 LYS C 1 22 LYS N -63.20 5.30 3.36 10.52 8.28 6.69 5 2 "[ - + 1 . 2]"
19 PHI 1 21 LYS C 1 22 LYS N 1 22 LYS CA 1 22 LYS C -134.80 -47.70 -66.11 -72.07 -75.73 . . 0 "[ . 1 . 2]"
20 PSI 1 22 LYS N 1 22 LYS CA 1 22 LYS C 1 23 ASP N -69.40 25.40 -32.53 -54.45 -14.51 . . 0 "[ . 1 . 2]"
21 PHI 1 23 ASP C 1 24 LYS N 1 24 LYS CA 1 24 LYS C -107.00 -64.70 -87.53 -95.99 -76.68 . . 0 "[ . 1 . 2]"
22 PSI 1 24 LYS N 1 24 LYS CA 1 24 LYS C 1 25 VAL N -69.10 3.80 -17.61 -12.07 -13.06 . . 0 "[ . 1 . 2]"
23 PHI 1 24 LYS C 1 25 VAL N 1 25 VAL CA 1 25 VAL C 45.00 -45.00 -135.60 -137.60 -138.27 . . 0 "[ . 1 . 2]"
24 PHI 1 24 LYS C 1 25 VAL N 1 25 VAL CA 1 25 VAL C 175.00 75.00 -135.60 -137.60 -138.27 . . 0 "[ . 1 . 2]"
25 PSI 1 25 VAL N 1 25 VAL CA 1 25 VAL C 1 26 VAL N 5.00 -165.00 96.88 85.25 81.58 . . 0 "[ . 1 . 2]"
26 PHI 1 25 VAL C 1 26 VAL N 1 26 VAL CA 1 26 VAL C -137.70 -95.20 -113.16 -136.00 -93.82 1.38 18 0 "[ . 1 . 2]"
27 PSI 1 26 VAL N 1 26 VAL CA 1 26 VAL C 1 27 VAL N 121.50 178.30 116.67 113.98 113.47 8.78 15 10 "[** .** 1-* *+ * *]"
28 PHI 1 26 VAL C 1 27 VAL N 1 27 VAL CA 1 27 VAL C -167.10 -104.60 -110.10 -119.80 -104.89 . . 0 "[ . 1 . 2]"
29 PSI 1 27 VAL N 1 27 VAL CA 1 27 VAL C 1 28 PHE N 134.00 174.00 148.22 142.87 152.66 . . 0 "[ . 1 . 2]"
30 PHI 1 27 VAL C 1 28 PHE N 1 28 PHE CA 1 28 PHE C -158.00 -86.20 -144.33 -146.91 -148.21 . . 0 "[ . 1 . 2]"
31 PSI 1 28 PHE N 1 28 PHE CA 1 28 PHE C 1 29 LEU N 105.60 165.10 107.25 100.78 112.11 4.82 20 0 "[ . 1 . 2]"
32 PHI 1 28 PHE C 1 29 LEU N 1 29 LEU CA 1 29 LEU C -167.10 -95.20 -151.51 -147.22 -147.93 . . 0 "[ . 1 . 2]"
33 PSI 1 29 LEU N 1 29 LEU CA 1 29 LEU C 1 30 LYS N 143.50 -169.10 153.77 149.07 159.18 . . 0 "[ . 1 . 2]"
34 PHI 1 29 LEU C 1 30 LYS N 1 30 LYS CA 1 30 LYS C -128.00 -70.70 -80.94 -92.99 -73.97 . . 0 "[ . 1 . 2]"
35 PSI 1 30 LYS N 1 30 LYS CA 1 30 LYS C 1 31 GLY N 74.80 155.00 62.41 63.69 63.04 15.42 11 20 [****-*****+*********]
36 PHI 1 31 GLY C 1 32 THR N 1 32 THR CA 1 32 THR C -172.70 -50.10 -134.81 -166.65 -116.20 . . 0 "[ . 1 . 2]"
37 PSI 1 32 THR N 1 32 THR CA 1 32 THR C 1 33 PRO N 79.20 -164.00 160.89 163.78 162.50 . . 0 "[ . 1 . 2]"
38 PSI 1 33 PRO N 1 33 PRO CA 1 33 PRO C 1 34 GLU N -41.20 -1.20 -24.27 -37.66 -15.98 . . 0 "[ . 1 . 2]"
39 PHI 1 33 PRO C 1 34 GLU N 1 34 GLU CA 1 34 GLU C -107.20 -54.00 -90.64 -90.11 -91.78 3.66 19 0 "[ . 1 . 2]"
40 PSI 1 34 GLU N 1 34 GLU CA 1 34 GLU C 1 35 GLN N -57.00 23.50 -18.27 -33.30 -0.26 . . 0 "[ . 1 . 2]"
41 PHI 1 34 GLU C 1 35 GLN N 1 35 GLN CA 1 35 GLN C -156.50 -65.90 -127.78 -138.98 -142.68 . . 0 "[ . 1 . 2]"
42 PSI 1 35 GLN N 1 35 GLN CA 1 35 GLN C 1 36 PRO N 33.50 156.40 115.51 75.52 141.28 . . 0 "[ . 1 . 2]"
43 PHI 1 39 GLY C 1 40 PHE N 1 40 PHE CA 1 40 PHE C -120.00 80.60 41.83 63.50 61.28 1.46 17 0 "[ . 1 . 2]"
44 PSI 1 40 PHE N 1 40 PHE CA 1 40 PHE C 1 41 SER N -100.00 60.00 -16.87 -62.13 21.09 . . 0 "[ . 1 . 2]"
45 PHI 1 40 PHE C 1 41 SER N 1 41 SER CA 1 41 SER C -81.90 -41.90 -68.60 -72.02 -76.14 2.49 5 0 "[ . 1 . 2]"
46 PSI 1 41 SER N 1 41 SER CA 1 41 SER C 1 42 ASN N -61.90 -21.90 -30.25 -37.76 -20.73 1.17 5 0 "[ . 1 . 2]"
47 PHI 1 41 SER C 1 42 ASN N 1 42 ASN CA 1 42 ASN C -82.70 -42.70 -80.14 -83.23 -84.74 3.81 9 0 "[ . 1 . 2]"
48 PSI 1 42 ASN N 1 42 ASN CA 1 42 ASN C 1 43 ALA N -65.60 -25.60 -33.13 -42.79 -25.32 0.28 9 0 "[ . 1 . 2]"
49 PHI 1 42 ASN C 1 43 ALA N 1 43 ALA CA 1 43 ALA C -83.60 -43.60 -58.43 -58.55 -59.44 . . 0 "[ . 1 . 2]"
50 PSI 1 43 ALA N 1 43 ALA CA 1 43 ALA C 1 44 VAL N -55.60 -15.60 -39.58 -45.22 -32.19 . . 0 "[ . 1 . 2]"
51 PHI 1 43 ALA C 1 44 VAL N 1 44 VAL CA 1 44 VAL C -85.70 -45.70 -70.18 -75.14 -63.49 . . 0 "[ . 1 . 2]"
52 PSI 1 44 VAL N 1 44 VAL CA 1 44 VAL C 1 45 VAL N -62.50 -22.50 -38.86 -38.45 -39.34 . . 0 "[ . 1 . 2]"
53 PHI 1 44 VAL C 1 45 VAL N 1 45 VAL CA 1 45 VAL C -80.00 -40.00 -75.37 -76.41 -76.84 . . 0 "[ . 1 . 2]"
54 PSI 1 45 VAL N 1 45 VAL CA 1 45 VAL C 1 46 GLN N -63.50 -23.50 -35.15 -34.81 -35.26 . . 0 "[ . 1 . 2]"
55 PHI 1 45 VAL C 1 46 GLN N 1 46 GLN CA 1 46 GLN C -85.30 -45.30 -59.83 -68.02 -55.30 . . 0 "[ . 1 . 2]"
56 PSI 1 46 GLN N 1 46 GLN CA 1 46 GLN C 1 47 ILE N -60.70 -20.70 -50.00 -47.69 -48.93 . . 0 "[ . 1 . 2]"
57 PHI 1 46 GLN C 1 47 ILE N 1 47 ILE CA 1 47 ILE C -83.70 -43.70 -60.55 -59.18 -60.05 . . 0 "[ . 1 . 2]"
58 PSI 1 47 ILE N 1 47 ILE CA 1 47 ILE C 1 48 LEU N -63.70 -23.70 -42.64 -43.98 -44.75 . . 0 "[ . 1 . 2]"
59 PHI 1 47 ILE C 1 48 LEU N 1 48 LEU CA 1 48 LEU C -82.60 -42.60 -60.54 -60.19 -60.59 . . 0 "[ . 1 . 2]"
60 PSI 1 48 LEU N 1 48 LEU CA 1 48 LEU C 1 49 ARG N -58.90 -18.90 -56.94 -59.54 -53.00 0.64 6 0 "[ . 1 . 2]"
61 PHI 1 48 LEU C 1 49 ARG N 1 49 ARG CA 1 49 ARG C -87.50 -47.50 -62.45 -68.49 -57.04 . . 0 "[ . 1 . 2]"
62 PSI 1 49 ARG N 1 49 ARG CA 1 49 ARG C 1 50 LEU N -58.40 -9.20 -32.27 -31.75 -32.80 . . 0 "[ . 1 . 2]"
63 PHI 1 49 ARG C 1 50 LEU N 1 50 LEU CA 1 50 LEU C -84.20 -44.20 -64.70 -69.44 -61.58 . . 0 "[ . 1 . 2]"
64 PSI 1 50 LEU N 1 50 LEU CA 1 50 LEU C 1 51 HIS N -60.40 -20.40 -38.09 -39.56 -39.89 . . 0 "[ . 1 . 2]"
65 PHI 1 50 LEU C 1 51 HIS N 1 51 HIS CA 1 51 HIS C -126.90 -68.30 -75.68 -78.95 -72.68 . . 0 "[ . 1 . 2]"
66 PSI 1 51 HIS N 1 51 HIS CA 1 51 HIS C 1 52 GLY N -26.80 13.20 1.50 -0.39 -1.59 . . 0 "[ . 1 . 2]"
67 PHI 1 51 HIS C 1 52 GLY N 1 52 GLY CA 1 52 GLY C 50.30 133.10 89.11 90.88 89.70 . . 0 "[ . 1 . 2]"
68 PSI 1 52 GLY N 1 52 GLY CA 1 52 GLY C 1 53 VAL N -11.60 44.90 7.18 -11.06 24.36 . . 0 "[ . 1 . 2]"
69 PHI 1 54 ARG C 1 55 ASP N 1 55 ASP CA 1 55 ASP C -125.90 -57.80 -92.67 -95.97 -100.34 . . 0 "[ . 1 . 2]"
70 PSI 1 55 ASP N 1 55 ASP CA 1 55 ASP C 1 56 TYR N -60.60 24.50 23.90 9.68 33.11 8.61 8 3 "[* . + - . 2]"
71 PHI 1 55 ASP C 1 56 TYR N 1 56 TYR CA 1 56 TYR C 172.70 -75.40 -70.00 -75.32 -63.76 11.64 1 12 "[+** .***-* *.** *2]"
72 PSI 1 56 TYR N 1 56 TYR CA 1 56 TYR C 1 57 ALA N 91.80 -165.40 163.88 158.28 170.05 . . 0 "[ . 1 . 2]"
73 PHI 1 56 TYR C 1 57 ALA N 1 57 ALA CA 1 57 ALA C -147.80 -77.60 -101.04 -108.76 -94.57 . . 0 "[ . 1 . 2]"
74 PSI 1 57 ALA N 1 57 ALA CA 1 57 ALA C 1 58 ALA N 82.10 168.90 113.66 110.44 109.71 . . 0 "[ . 1 . 2]"
75 PHI 1 57 ALA C 1 58 ALA N 1 58 ALA CA 1 58 ALA C -140.60 -73.70 -91.82 -105.09 -82.76 . . 0 "[ . 1 . 2]"
76 PSI 1 58 ALA N 1 58 ALA CA 1 58 ALA C 1 59 TYR N 100.00 161.90 104.49 97.28 120.14 2.72 15 0 "[ . 1 . 2]"
77 PHI 1 58 ALA C 1 59 TYR N 1 59 TYR CA 1 59 TYR C 166.20 -58.50 -79.48 -81.52 -82.72 . . 0 "[ . 1 . 2]"
78 PSI 1 59 TYR N 1 59 TYR CA 1 59 TYR C 1 60 ASN N 113.60 174.60 117.23 114.14 113.46 0.62 3 0 "[ . 1 . 2]"
79 PHI 1 60 ASN C 1 61 VAL N 1 61 VAL CA 1 61 VAL C -109.70 -30.30 -80.39 -86.02 -86.18 . . 0 "[ . 1 . 2]"
80 PSI 1 61 VAL N 1 61 VAL CA 1 61 VAL C 1 62 LEU N -54.20 23.30 1.12 -29.18 14.90 . . 0 "[ . 1 . 2]"
81 PHI 1 61 VAL C 1 62 LEU N 1 62 LEU CA 1 62 LEU C -92.00 -52.00 -77.04 -92.29 -59.35 0.29 2 0 "[ . 1 . 2]"
82 PSI 1 62 LEU N 1 62 LEU CA 1 62 LEU C 1 63 ASP N -51.20 16.30 -29.27 -14.25 -15.92 . . 0 "[ . 1 . 2]"
83 PHI 1 62 LEU C 1 63 ASP N 1 63 ASP CA 1 63 ASP C -113.40 -70.40 -72.85 -67.69 -68.38 4.07 12 0 "[ . 1 . 2]"
84 PSI 1 63 ASP N 1 63 ASP CA 1 63 ASP C 1 64 ASP N -46.80 31.60 -37.84 -38.87 -43.64 1.24 17 0 "[ . 1 . 2]"
85 PHI 1 63 ASP C 1 64 ASP N 1 64 ASP CA 1 64 ASP C -167.20 -80.40 -122.37 -144.90 -98.48 . . 0 "[ . 1 . 2]"
86 PSI 1 64 ASP N 1 64 ASP CA 1 64 ASP C 1 65 PRO N 34.10 131.50 115.96 131.94 131.57 0.44 2 0 "[ . 1 . 2]"
87 PSI 1 65 PRO N 1 65 PRO CA 1 65 PRO C 1 66 GLU N -52.50 -12.50 -22.80 -25.91 -27.59 . . 0 "[ . 1 . 2]"
88 PHI 1 65 PRO C 1 66 GLU N 1 66 GLU CA 1 66 GLU C -84.00 -44.00 -62.68 -64.99 -66.41 . . 0 "[ . 1 . 2]"
89 PSI 1 66 GLU N 1 66 GLU CA 1 66 GLU C 1 67 LEU N -56.20 -16.20 -43.74 -53.29 -36.83 . . 0 "[ . 1 . 2]"
90 PHI 1 66 GLU C 1 67 LEU N 1 67 LEU CA 1 67 LEU C -85.60 -45.60 -66.58 -74.23 -61.58 . . 0 "[ . 1 . 2]"
91 PSI 1 67 LEU N 1 67 LEU CA 1 67 LEU C 1 68 ARG N -59.90 -19.90 -43.33 -45.69 -48.00 . . 0 "[ . 1 . 2]"
92 PHI 1 67 LEU C 1 68 ARG N 1 68 ARG CA 1 68 ARG C -84.40 -41.10 -57.67 -62.39 -52.99 . . 0 "[ . 1 . 2]"
93 PSI 1 68 ARG N 1 68 ARG CA 1 68 ARG C 1 69 GLN N -62.40 -22.40 -55.34 -57.86 -58.73 0.53 1 0 "[ . 1 . 2]"
94 PHI 1 68 ARG C 1 69 GLN N 1 69 GLN CA 1 69 GLN C 175.00 -45.00 -66.34 -70.32 -75.19 . . 0 "[ . 1 . 2]"
95 PSI 1 69 GLN N 1 69 GLN CA 1 69 GLN C 1 70 GLY N -85.00 -5.00 -42.17 -50.25 -31.34 . . 0 "[ . 1 . 2]"
96 PHI 1 69 GLN C 1 70 GLY N 1 70 GLY CA 1 70 GLY C 45.00 -45.00 -53.90 -50.89 -52.17 0.13 7 0 "[ . 1 . 2]"
97 PSI 1 70 GLY N 1 70 GLY CA 1 70 GLY C 1 71 ILE N -135.00 135.00 -43.07 -44.54 -44.97 . . 0 "[ . 1 . 2]"
98 PHI 1 70 GLY C 1 71 ILE N 1 71 ILE CA 1 71 ILE C -139.00 -28.80 -84.83 -93.66 -77.53 . . 0 "[ . 1 . 2]"
99 PSI 1 71 ILE N 1 71 ILE CA 1 71 ILE C 1 72 LYS N -81.90 49.70 -34.34 -35.86 -36.52 . . 0 "[ . 1 . 2]"
100 PHI 1 71 ILE C 1 72 LYS N 1 72 LYS CA 1 72 LYS C -82.00 -42.00 -59.55 -63.43 -54.81 . . 0 "[ . 1 . 2]"
101 PSI 1 72 LYS N 1 72 LYS CA 1 72 LYS C 1 73 ASP N -61.00 -21.00 -36.30 -41.09 -49.34 . . 0 "[ . 1 . 2]"
102 PHI 1 72 LYS C 1 73 ASP N 1 73 ASP CA 1 73 ASP C -85.10 -45.10 -76.62 -83.29 -64.29 . . 0 "[ . 1 . 2]"
103 PSI 1 73 ASP N 1 73 ASP CA 1 73 ASP C 1 74 TYR N -60.50 -20.50 -54.63 -62.81 -46.16 2.31 5 0 "[ . 1 . 2]"
104 PHI 1 73 ASP C 1 74 TYR N 1 74 TYR CA 1 74 TYR C -89.00 -48.70 -61.89 -70.20 -53.37 . . 0 "[ . 1 . 2]"
105 PSI 1 74 TYR N 1 74 TYR CA 1 74 TYR C 1 75 SER N -64.60 -6.00 -37.06 -25.73 -31.56 . . 0 "[ . 1 . 2]"
106 PHI 1 74 TYR C 1 75 SER N 1 75 SER CA 1 75 SER C -114.50 -74.50 -91.99 -103.03 -82.87 . . 0 "[ . 1 . 2]"
107 PSI 1 75 SER N 1 75 SER CA 1 75 SER C 1 76 ASN N -22.00 24.30 -1.20 -6.76 -10.05 . . 0 "[ . 1 . 2]"
108 PHI 1 75 SER C 1 76 ASN N 1 76 ASN CA 1 76 ASN C 40.20 96.60 55.00 51.72 49.02 . . 0 "[ . 1 . 2]"
109 PSI 1 76 ASN N 1 76 ASN CA 1 76 ASN C 1 77 TRP N -0.30 60.00 19.10 -1.13 35.62 0.83 5 0 "[ . 1 . 2]"
110 PHI 1 76 ASN C 1 77 TRP N 1 77 TRP CA 1 77 TRP C -128.40 -64.70 -123.21 -124.10 -125.68 2.96 12 0 "[ . 1 . 2]"
111 PSI 1 77 TRP N 1 77 TRP CA 1 77 TRP C 1 78 PRO N 86.50 164.60 140.60 133.49 150.16 . . 0 "[ . 1 . 2]"
112 PHI 1 78 PRO C 1 79 THR N 1 79 THR CA 1 79 THR C 45.00 -45.00 -160.51 174.69 -122.08 . . 0 "[ . 1 . 2]"
113 PHI 1 78 PRO C 1 79 THR N 1 79 THR CA 1 79 THR C 175.00 75.00 -160.51 174.69 -122.08 0.31 2 0 "[ . 1 . 2]"
114 PSI 1 79 THR N 1 79 THR CA 1 79 THR C 1 80 ILE N -15.00 -165.00 97.79 -18.52 138.99 3.52 20 0 "[ . 1 . 2]"
115 PHI 1 79 THR C 1 80 ILE N 1 80 ILE CA 1 80 ILE C -136.40 -79.60 -132.99 -139.18 -139.76 8.62 9 6 "[* . +1 * *. - *2]"
116 PSI 1 80 ILE N 1 80 ILE CA 1 80 ILE C 1 81 PRO N 63.30 177.00 144.62 120.97 -179.25 3.75 7 0 "[ . 1 . 2]"
117 PSI 1 81 PRO N 1 81 PRO CA 1 81 PRO C 1 82 GLN N 131.60 174.90 145.97 140.95 140.94 0.89 16 0 "[ . 1 . 2]"
118 PHI 1 81 PRO C 1 82 GLN N 1 82 GLN CA 1 82 GLN C 173.20 -89.80 -134.68 -157.17 -122.75 . . 0 "[ . 1 . 2]"
119 PSI 1 82 GLN N 1 82 GLN CA 1 82 GLN C 1 83 VAL N 135.30 176.40 166.70 172.34 169.21 1.25 12 0 "[ . 1 . 2]"
120 PHI 1 82 GLN C 1 83 VAL N 1 83 VAL CA 1 83 VAL C -154.20 -109.00 -133.91 -140.58 -118.37 . . 0 "[ . 1 . 2]"
121 PSI 1 83 VAL N 1 83 VAL CA 1 83 VAL C 1 84 TYR N 107.10 148.20 142.76 139.40 138.35 8.45 18 5 "[ . *1 * . *+ -]"
122 PHI 1 83 VAL C 1 84 TYR N 1 84 TYR CA 1 84 TYR C 179.90 -71.80 -115.60 -109.47 -111.82 . . 0 "[ . 1 . 2]"
123 PSI 1 84 TYR N 1 84 TYR CA 1 84 TYR C 1 85 LEU N 92.30 -156.50 131.67 118.38 141.09 . . 0 "[ . 1 . 2]"
124 PHI 1 84 TYR C 1 85 LEU N 1 85 LEU CA 1 85 LEU C -142.40 -83.50 -109.13 -113.80 -99.51 . . 0 "[ . 1 . 2]"
125 PSI 1 85 LEU N 1 85 LEU CA 1 85 LEU C 1 86 ASN N 102.50 159.80 127.31 127.52 126.62 . . 0 "[ . 1 . 2]"
126 PHI 1 86 ASN C 1 87 GLY N 1 87 GLY CA 1 87 GLY C 41.50 106.30 72.61 65.55 81.40 . . 0 "[ . 1 . 2]"
127 PSI 1 87 GLY N 1 87 GLY CA 1 87 GLY C 1 88 GLU N -40.40 55.30 5.27 -12.28 20.54 . . 0 "[ . 1 . 2]"
128 PHI 1 87 GLY C 1 88 GLU N 1 88 GLU CA 1 88 GLU C -142.20 -65.10 -110.58 -139.74 -88.29 . . 0 "[ . 1 . 2]"
129 PSI 1 88 GLU N 1 88 GLU CA 1 88 GLU C 1 89 PHE N 113.40 165.10 146.37 147.43 146.80 . . 0 "[ . 1 . 2]"
130 PHI 1 88 GLU C 1 89 PHE N 1 89 PHE CA 1 89 PHE C -103.50 -53.50 -80.52 -78.89 -81.55 . . 0 "[ . 1 . 2]"
131 PSI 1 89 PHE N 1 89 PHE CA 1 89 PHE C 1 90 VAL N 97.90 137.90 138.70 139.22 138.02 9.85 12 2 "[ . 1 + . -]"
132 PHI 1 89 PHE C 1 90 VAL N 1 90 VAL CA 1 90 VAL C -155.00 -45.00 -150.55 -157.51 -132.88 2.51 4 0 "[ . 1 . 2]"
133 PSI 1 90 VAL N 1 90 VAL CA 1 90 VAL C 1 91 GLY N -85.00 5.00 -44.53 -39.78 -42.76 . . 0 "[ . 1 . 2]"
134 PHI 1 92 GLY C 1 93 CYS N 1 93 CYS CA 1 93 CYS C -78.70 -38.70 -59.57 -55.77 -57.33 . . 0 "[ . 1 . 2]"
135 PSI 1 93 CYS N 1 93 CYS CA 1 93 CYS C 1 94 ASP N -61.60 -21.60 -30.22 -41.57 -17.82 3.78 19 0 "[ . 1 . 2]"
136 PHI 1 93 CYS C 1 94 ASP N 1 94 ASP CA 1 94 ASP C -82.70 -42.70 -72.27 -68.15 -68.62 . . 0 "[ . 1 . 2]"
137 PSI 1 94 ASP N 1 94 ASP CA 1 94 ASP C 1 95 ILE N -58.50 -18.50 -30.70 -32.97 -34.08 1.60 15 0 "[ . 1 . 2]"
138 PHI 1 94 ASP C 1 95 ILE N 1 95 ILE CA 1 95 ILE C -86.20 -46.20 -78.15 -88.42 -71.28 2.22 18 0 "[ . 1 . 2]"
139 PSI 1 95 ILE N 1 95 ILE CA 1 95 ILE C 1 96 LEU N -59.60 -19.60 -43.42 -44.78 -44.79 . . 0 "[ . 1 . 2]"
140 PHI 1 95 ILE C 1 96 LEU N 1 96 LEU CA 1 96 LEU C -85.40 -45.40 -55.10 -54.23 -54.99 . . 0 "[ . 1 . 2]"
141 PSI 1 96 LEU N 1 96 LEU CA 1 96 LEU C 1 97 LEU N -62.00 -22.00 -34.46 -34.41 -34.62 . . 0 "[ . 1 . 2]"
142 PHI 1 96 LEU C 1 97 LEU N 1 97 LEU CA 1 97 LEU C -81.90 -41.90 -68.95 -62.34 -66.95 . . 0 "[ . 1 . 2]"
143 PSI 1 97 LEU N 1 97 LEU CA 1 97 LEU C 1 98 GLN N -59.30 -19.30 -25.93 -53.16 -17.63 1.67 6 0 "[ . 1 . 2]"
144 PHI 1 97 LEU C 1 98 GLN N 1 98 GLN CA 1 98 GLN C -85.40 -45.40 -78.78 -59.22 -66.22 0.67 6 0 "[ . 1 . 2]"
145 PSI 1 98 GLN N 1 98 GLN CA 1 98 GLN C 1 99 MET N -61.20 -21.20 -53.79 -51.59 -52.45 . . 0 "[ . 1 . 2]"
146 PHI 1 98 GLN C 1 99 MET N 1 99 MET CA 1 99 MET C -87.50 -47.50 -67.92 -70.87 -71.00 . . 0 "[ . 1 . 2]"
147 PSI 1 99 MET N 1 99 MET CA 1 99 MET C 1 100 HIS N -57.40 -17.40 -29.98 -30.74 -30.95 . . 0 "[ . 1 . 2]"
148 PHI 1 99 MET C 1 100 HIS N 1 100 HIS CA 1 100 HIS C -85.30 -45.30 -54.43 -58.35 -49.75 . . 0 "[ . 1 . 2]"
149 PSI 1 100 HIS N 1 100 HIS CA 1 100 HIS C 1 101 GLN N -65.30 -25.30 -48.31 -52.31 -43.95 . . 0 "[ . 1 . 2]"
150 PHI 1 100 HIS C 1 101 GLN N 1 101 GLN CA 1 101 GLN C -89.00 -49.00 -93.11 -91.84 -92.11 6.54 9 3 "[ * .- +1 . 2]"
151 PSI 1 101 GLN N 1 101 GLN CA 1 101 GLN C 1 102 ASN N -57.80 -0.50 -24.17 -6.13 -16.30 . . 0 "[ . 1 . 2]"
152 PHI 1 101 GLN C 1 102 ASN N 1 102 ASN CA 1 102 ASN C -112.30 -72.30 -79.92 -95.52 -70.66 1.64 16 0 "[ . 1 . 2]"
153 PSI 1 102 ASN N 1 102 ASN CA 1 102 ASN C 1 103 GLY N -30.90 19.30 -30.85 -35.47 -21.85 4.57 16 0 "[ . 1 . 2]"
154 PHI 1 103 GLY C 1 104 ASP N 1 104 ASP CA 1 104 ASP C -78.60 -38.60 -73.61 -74.97 -77.18 1.28 1 0 "[ . 1 . 2]"
155 PSI 1 104 ASP N 1 104 ASP CA 1 104 ASP C 1 105 LEU N -58.60 -13.10 -12.20 -17.26 -7.20 5.90 15 1 "[ . 1 + 2]"
156 PHI 1 104 ASP C 1 105 LEU N 1 105 LEU CA 1 105 LEU C -84.20 -44.20 -74.77 -72.89 -73.47 . . 0 "[ . 1 . 2]"
157 PSI 1 105 LEU N 1 105 LEU CA 1 105 LEU C 1 106 VAL N -63.40 -23.40 -26.98 -35.47 -23.18 0.22 5 0 "[ . 1 . 2]"
158 PHI 1 105 LEU C 1 106 VAL N 1 106 VAL CA 1 106 VAL C -80.60 -40.60 -76.56 -78.24 -80.38 0.45 14 0 "[ . 1 . 2]"
159 PSI 1 106 VAL N 1 106 VAL CA 1 106 VAL C 1 107 GLU N -60.20 -20.20 -38.13 -39.61 -40.58 . . 0 "[ . 1 . 2]"
160 PHI 1 106 VAL C 1 107 GLU N 1 107 GLU CA 1 107 GLU C -83.30 -43.30 -67.89 -75.36 -45.65 . . 0 "[ . 1 . 2]"
161 PSI 1 107 GLU N 1 107 GLU CA 1 107 GLU C 1 108 GLU N -62.00 -22.00 -38.63 -37.81 -40.57 1.50 9 0 "[ . 1 . 2]"
162 PHI 1 107 GLU C 1 108 GLU N 1 108 GLU CA 1 108 GLU C -84.60 -44.60 -64.65 -75.34 -57.99 . . 0 "[ . 1 . 2]"
163 PSI 1 108 GLU N 1 108 GLU CA 1 108 GLU C 1 109 LEU N -62.60 -22.60 -40.01 -40.26 -41.38 . . 0 "[ . 1 . 2]"
164 PHI 1 108 GLU C 1 109 LEU N 1 109 LEU CA 1 109 LEU C -82.40 -42.40 -65.14 -62.90 -63.21 . . 0 "[ . 1 . 2]"
165 PSI 1 109 LEU N 1 109 LEU CA 1 109 LEU C 1 110 LYS N -59.10 -19.10 -40.25 -45.35 -34.04 . . 0 "[ . 1 . 2]"
166 PHI 1 109 LEU C 1 110 LYS N 1 110 LYS CA 1 110 LYS C -85.30 -45.30 -61.76 -75.99 -44.41 0.89 9 0 "[ . 1 . 2]"
167 PSI 1 110 LYS N 1 110 LYS CA 1 110 LYS C 1 111 LYS N -58.60 -17.20 -31.40 -49.48 -21.13 . . 0 "[ . 1 . 2]"
168 PHI 1 110 LYS C 1 111 LYS N 1 111 LYS CA 1 111 LYS C -85.30 -45.30 -64.43 -76.78 -57.20 . . 0 "[ . 1 . 2]"
169 PSI 1 111 LYS N 1 111 LYS CA 1 111 LYS C 1 112 LEU N -48.00 -8.00 -29.81 -31.21 -34.26 . . 0 "[ . 1 . 2]"
170 PHI 1 111 LYS C 1 112 LEU N 1 112 LEU CA 1 112 LEU C -111.20 -71.20 -85.19 -98.57 -73.00 . . 0 "[ . 1 . 2]"
171 PSI 1 112 LEU N 1 112 LEU CA 1 112 LEU C 1 113 GLY N -27.60 19.10 -6.82 -3.39 -5.34 . . 0 "[ . 1 . 2]"
172 PHI 1 112 LEU C 1 113 GLY N 1 113 GLY CA 1 113 GLY C 63.20 103.20 78.84 70.94 97.48 . . 0 "[ . 1 . 2]"
173 PSI 1 113 GLY N 1 113 GLY CA 1 113 GLY C 1 114 ILE N -13.10 33.30 5.74 -13.16 20.33 0.06 20 0 "[ . 1 . 2]"
174 PHI 1 113 GLY C 1 114 ILE N 1 114 ILE CA 1 114 ILE C -142.20 -40.80 -78.69 -87.68 -91.12 . . 0 "[ . 1 . 2]"
175 PSI 1 114 ILE N 1 114 ILE CA 1 114 ILE C 1 115 HIS N 100.10 163.90 136.55 131.54 146.50 . . 0 "[ . 1 . 2]"
176 PHI 1 114 ILE C 1 115 HIS N 1 115 HIS CA 1 115 HIS C -141.10 -61.00 -87.43 -102.72 -115.73 . . 0 "[ . 1 . 2]"
177 PSI 1 115 HIS N 1 115 HIS CA 1 115 HIS C 1 116 SER N 76.30 148.90 111.96 112.13 110.97 . . 0 "[ . 1 . 2]"
178 PHI 1 115 HIS C 1 116 SER N 1 116 SER CA 1 116 SER C -139.10 -37.20 -60.35 -66.60 -55.91 . . 0 "[ . 1 . 2]"
179 PSI 1 116 SER N 1 116 SER CA 1 116 SER C 1 117 ALA N 66.30 170.40 126.47 120.41 118.38 . . 0 "[ . 1 . 2]"
180 PHI 1 116 SER C 1 117 ALA N 1 117 ALA CA 1 117 ALA C -83.10 -43.10 -63.29 -58.21 -61.12 . . 0 "[ . 1 . 2]"
181 PSI 1 117 ALA N 1 117 ALA CA 1 117 ALA C 1 118 LEU N -44.80 -2.20 -14.28 -29.51 -0.90 1.30 4 0 "[ . 1 . 2]"
182 PHI 1 117 ALA C 1 118 LEU N 1 118 LEU CA 1 118 LEU C -110.90 -67.00 -80.14 -71.99 -77.30 1.17 13 0 "[ . 1 . 2]"
183 PSI 1 118 LEU N 1 118 LEU CA 1 118 LEU C 1 119 LEU N -35.20 22.20 -8.86 -33.23 4.79 . . 0 "[ . 1 . 2]"
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