NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
612673 | 5u3h | 30205 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5u3h save_dihedral_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 146 _TA_constraint_stats_list.Viol_count 256 _TA_constraint_stats_list.Viol_total 8970.04 _TA_constraint_stats_list.Viol_max 7.84 _TA_constraint_stats_list.Viol_rms 0.63 _TA_constraint_stats_list.Viol_average_all_restraints 0.15 _TA_constraint_stats_list.Viol_average_violations_only 1.75 _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 PHI 1 3 ILE C 1 4 ASP N 1 4 ASP CA 1 4 ASP C -105.60 -65.60 -75.38 -97.18 -66.03 . . 0 "[ . 1 . 2]" 2 PSI 1 4 ASP N 1 4 ASP CA 1 4 ASP C 1 5 TYR N 80.20 130.40 101.30 126.95 111.25 5.03 2 1 "[ + . 1 . 2]" 3 PHI 1 4 ASP C 1 5 TYR N 1 5 TYR CA 1 5 TYR C -85.00 -45.00 -76.09 -86.92 -61.72 1.92 4 0 "[ . 1 . 2]" 4 PSI 1 5 TYR N 1 5 TYR CA 1 5 TYR C 1 6 GLN N -46.70 -6.70 -24.57 -45.97 -4.61 2.09 1 0 "[ . 1 . 2]" 5 PHI 1 5 TYR C 1 6 GLN N 1 6 GLN CA 1 6 GLN C -87.80 -47.80 -68.57 -87.82 -51.81 0.02 7 0 "[ . 1 . 2]" 6 PSI 1 6 GLN N 1 6 GLN CA 1 6 GLN C 1 7 ALA N -55.50 -15.50 -33.91 -58.25 -14.48 2.75 18 0 "[ . 1 . 2]" 7 PHI 1 6 GLN C 1 7 ALA N 1 7 ALA CA 1 7 ALA C -88.50 -48.50 -70.31 -76.45 -81.03 . . 0 "[ . 1 . 2]" 8 PSI 1 7 ALA N 1 7 ALA CA 1 7 ALA C 1 8 LEU N -55.40 -15.40 -28.13 -56.01 -13.18 2.22 19 0 "[ . 1 . 2]" 9 PHI 1 22 ALA C 1 23 ASP N 1 23 ASP CA 1 23 ASP C -121.30 -74.40 -102.21 -112.28 -114.73 2.61 17 0 "[ . 1 . 2]" 10 PSI 1 23 ASP N 1 23 ASP CA 1 23 ASP C 1 24 LEU N -21.10 27.50 15.52 15.61 11.26 4.09 17 0 "[ . 1 . 2]" 11 PHI 1 23 ASP C 1 24 LEU N 1 24 LEU CA 1 24 LEU C -91.20 -51.20 -57.45 -61.72 -64.39 1.48 8 0 "[ . 1 . 2]" 12 PSI 1 24 LEU N 1 24 LEU CA 1 24 LEU C 1 25 PRO N 113.80 159.00 136.73 137.84 135.10 1.94 18 0 "[ . 1 . 2]" 13 PSI 1 25 PRO N 1 25 PRO CA 1 25 PRO C 1 26 GLN N 122.90 162.90 125.03 117.64 150.07 5.26 11 1 "[ . 1+ . 2]" 14 PHI 1 25 PRO C 1 26 GLN N 1 26 GLN CA 1 26 GLN C -149.50 -43.10 -122.30 -104.04 -112.70 . . 0 "[ . 1 . 2]" 15 PSI 1 26 GLN N 1 26 GLN CA 1 26 GLN C 1 27 GLY N 56.90 -163.10 103.00 49.06 142.92 7.84 17 1 "[ . 1 . + 2]" 16 PHI 1 27 GLY C 1 28 ASP N 1 28 ASP CA 1 28 ASP C -82.20 -42.20 -62.88 -82.50 -51.08 0.30 16 0 "[ . 1 . 2]" 17 PSI 1 28 ASP N 1 28 ASP CA 1 28 ASP C 1 29 ILE N -58.10 -18.10 -45.96 -54.39 -38.08 . . 0 "[ . 1 . 2]" 18 PHI 1 28 ASP C 1 29 ILE N 1 29 ILE CA 1 29 ILE C -83.90 -43.90 -74.34 -70.14 -71.01 0.98 10 0 "[ . 1 . 2]" 19 PSI 1 29 ILE N 1 29 ILE CA 1 29 ILE C 1 30 GLU N -66.00 -26.00 -40.93 -36.75 -39.72 . . 0 "[ . 1 . 2]" 20 PHI 1 29 ILE C 1 30 GLU N 1 30 GLU CA 1 30 GLU C -82.70 -42.70 -62.83 -69.26 -54.35 . . 0 "[ . 1 . 2]" 21 PSI 1 30 GLU N 1 30 GLU CA 1 30 GLU C 1 31 LYS N -62.20 -22.20 -40.65 -49.64 -32.99 . . 0 "[ . 1 . 2]" 22 PHI 1 30 GLU C 1 31 LYS N 1 31 LYS CA 1 31 LYS C -84.30 -44.30 -70.46 -74.16 -78.17 . . 0 "[ . 1 . 2]" 23 PSI 1 31 LYS N 1 31 LYS CA 1 31 LYS C 1 32 GLN N -61.40 -21.40 -33.73 -30.79 -31.41 . . 0 "[ . 1 . 2]" 24 PHI 1 31 LYS C 1 32 GLN N 1 32 GLN CA 1 32 GLN C -85.20 -45.20 -67.42 -65.92 -66.33 . . 0 "[ . 1 . 2]" 25 PSI 1 32 GLN N 1 32 GLN CA 1 32 GLN C 1 33 VAL N -61.80 -21.80 -50.57 -60.80 -38.86 . . 0 "[ . 1 . 2]" 26 PHI 1 32 GLN C 1 33 VAL N 1 33 VAL CA 1 33 VAL C -83.60 -43.60 -63.15 -63.08 -63.81 . . 0 "[ . 1 . 2]" 27 PSI 1 33 VAL N 1 33 VAL CA 1 33 VAL C 1 34 ALA N -63.60 -23.60 -38.16 -38.42 -39.58 . . 0 "[ . 1 . 2]" 28 PHI 1 33 VAL C 1 34 ALA N 1 34 ALA CA 1 34 ALA C -83.80 -43.80 -61.35 -68.69 -57.21 . . 0 "[ . 1 . 2]" 29 PSI 1 34 ALA N 1 34 ALA CA 1 34 ALA C 1 35 ALA N -60.00 -20.00 -47.00 -49.81 -50.35 . . 0 "[ . 1 . 2]" 30 PHI 1 34 ALA C 1 35 ALA N 1 35 ALA CA 1 35 ALA C -85.20 -45.20 -59.85 -64.23 -55.53 . . 0 "[ . 1 . 2]" 31 PSI 1 35 ALA N 1 35 ALA CA 1 35 ALA C 1 36 LEU N -61.20 -21.20 -42.14 -35.33 -38.39 . . 0 "[ . 1 . 2]" 32 PHI 1 35 ALA C 1 36 LEU N 1 36 LEU CA 1 36 LEU C -85.40 -45.40 -67.92 -74.13 -62.18 . . 0 "[ . 1 . 2]" 33 PSI 1 36 LEU N 1 36 LEU CA 1 36 LEU C 1 37 TRP N -62.40 -22.40 -39.88 -54.24 -33.82 . . 0 "[ . 1 . 2]" 34 PHI 1 36 LEU C 1 37 TRP N 1 37 TRP CA 1 37 TRP C -82.90 -42.90 -66.35 -72.18 -58.66 . . 0 "[ . 1 . 2]" 35 PSI 1 37 TRP N 1 37 TRP CA 1 37 TRP C 1 38 GLN N -63.60 -23.60 -36.21 -42.14 -28.58 . . 0 "[ . 1 . 2]" 36 PHI 1 37 TRP C 1 38 GLN N 1 38 GLN CA 1 38 GLN C -83.40 -43.40 -69.73 -66.55 -67.43 . . 0 "[ . 1 . 2]" 37 PSI 1 38 GLN N 1 38 GLN CA 1 38 GLN C 1 39 GLN N -59.00 -19.00 -27.14 -48.44 -17.95 1.05 6 0 "[ . 1 . 2]" 38 PHI 1 38 GLN C 1 39 GLN N 1 39 GLN CA 1 39 GLN C -89.50 -49.50 -82.95 -93.05 -70.00 3.55 11 0 "[ . 1 . 2]" 39 PSI 1 39 GLN N 1 39 GLN CA 1 39 GLN C 1 40 LEU N -61.60 -21.60 -56.96 -63.66 -41.38 2.06 20 0 "[ . 1 . 2]" 40 PHI 1 39 GLN C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -89.20 -49.20 -64.95 -63.15 -65.10 . . 0 "[ . 1 . 2]" 41 PSI 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 LEU N -56.70 -16.70 -46.46 -57.27 -32.88 0.57 4 0 "[ . 1 . 2]" 42 PHI 1 40 LEU C 1 41 LEU N 1 41 LEU CA 1 41 LEU C -111.70 -71.70 -80.18 -99.94 -70.61 1.09 12 0 "[ . 1 . 2]" 43 PSI 1 41 LEU N 1 41 LEU CA 1 41 LEU C 1 42 SER N -23.70 16.30 -17.96 -25.86 -10.61 2.16 15 0 "[ . 1 . 2]" 44 PHI 1 42 SER C 1 43 THR N 1 43 THR CA 1 43 THR C -154.60 -102.20 -104.67 -101.46 -104.85 4.25 2 0 "[ . 1 . 2]" 45 PSI 1 43 THR N 1 43 THR CA 1 43 THR C 1 44 GLY N 125.20 -174.40 157.89 145.99 178.92 . . 0 "[ . 1 . 2]" 46 PHI 1 45 ASN C 1 46 VAL N 1 46 VAL CA 1 46 VAL C -134.00 -57.50 -113.41 -136.29 -70.40 2.29 13 0 "[ . 1 . 2]" 47 PSI 1 46 VAL N 1 46 VAL CA 1 46 VAL C 1 47 THR N 106.20 161.60 140.39 126.28 156.86 . . 0 "[ . 1 . 2]" 48 PHI 1 46 VAL C 1 47 THR N 1 47 THR CA 1 47 THR C -150.80 -103.00 -118.52 -135.39 -102.34 0.66 5 0 "[ . 1 . 2]" 49 PSI 1 47 THR N 1 47 THR CA 1 47 THR C 1 48 ARG N 155.90 -164.10 -179.74 175.27 172.43 . . 0 "[ . 1 . 2]" 50 PHI 1 47 THR C 1 48 ARG N 1 48 ARG CA 1 48 ARG C -84.10 -44.10 -58.09 -50.98 -53.44 0.59 6 0 "[ . 1 . 2]" 51 PSI 1 48 ARG N 1 48 ARG CA 1 48 ARG C 1 49 GLU N -46.40 -4.20 -37.85 -51.59 -20.39 5.19 15 1 "[ . 1 + 2]" 52 PHI 1 49 GLU C 1 50 THR N 1 50 THR CA 1 50 THR C -85.40 -45.40 -70.28 -77.77 -79.35 1.35 6 0 "[ . 1 . 2]" 53 PSI 1 50 THR N 1 50 THR CA 1 50 THR C 1 51 ASP N 118.30 158.30 129.81 117.59 139.53 0.71 17 0 "[ . 1 . 2]" 54 PHI 1 50 THR C 1 51 ASP N 1 51 ASP CA 1 51 ASP C -150.60 -96.40 -95.13 -106.41 -92.28 4.12 10 0 "[ . 1 . 2]" 55 PSI 1 51 ASP N 1 51 ASP CA 1 51 ASP C 1 52 PHE N 81.40 153.70 133.11 116.41 149.66 . . 0 "[ . 1 . 2]" 56 PHI 1 51 ASP C 1 52 PHE N 1 52 PHE CA 1 52 PHE C -78.00 -38.00 -55.78 -47.54 -49.10 . . 0 "[ . 1 . 2]" 57 PSI 1 52 PHE N 1 52 PHE CA 1 52 PHE C 1 53 PHE N -62.40 -22.40 -51.51 -54.23 -54.96 0.84 5 0 "[ . 1 . 2]" 58 PHI 1 52 PHE C 1 53 PHE N 1 53 PHE CA 1 53 PHE C -84.80 -44.80 -73.02 -81.44 -66.30 . . 0 "[ . 1 . 2]" 59 PSI 1 53 PHE N 1 53 PHE CA 1 53 PHE C 1 54 GLN N -53.50 -9.10 -35.98 -46.45 -21.34 . . 0 "[ . 1 . 2]" 60 PHI 1 53 PHE C 1 54 GLN N 1 54 GLN CA 1 54 GLN C -90.90 -50.90 -67.98 -67.12 -68.53 . . 0 "[ . 1 . 2]" 61 PSI 1 54 GLN N 1 54 GLN CA 1 54 GLN C 1 55 GLN N -40.80 -0.80 -31.25 -40.99 -11.95 0.19 4 0 "[ . 1 . 2]" 62 PHI 1 54 GLN C 1 55 GLN N 1 55 GLN CA 1 55 GLN C -106.80 -66.80 -77.57 -80.00 -83.34 . . 0 "[ . 1 . 2]" 63 PSI 1 55 GLN N 1 55 GLN CA 1 55 GLN C 1 56 GLY N -18.80 21.20 -2.87 -21.77 26.26 5.06 14 1 "[ . 1 +. 2]" 64 PHI 1 55 GLN C 1 56 GLY N 1 56 GLY CA 1 56 GLY C 80.70 120.70 108.35 114.68 100.94 2.40 20 0 "[ . 1 . 2]" 65 PSI 1 56 GLY N 1 56 GLY CA 1 56 GLY C 1 57 GLY N -12.80 27.20 6.57 -14.17 24.34 1.37 11 0 "[ . 1 . 2]" 66 PHI 1 56 GLY C 1 57 GLY N 1 57 GLY CA 1 57 GLY C -96.00 -50.10 -79.15 -76.19 -79.64 1.16 6 0 "[ . 1 . 2]" 67 PSI 1 57 GLY N 1 57 GLY CA 1 57 GLY C 1 58 ASP N 132.40 178.70 144.15 157.02 150.95 3.60 9 0 "[ . 1 . 2]" 68 PHI 1 57 GLY C 1 58 ASP N 1 58 ASP CA 1 58 ASP C -146.60 -45.30 -112.27 -130.09 -136.30 1.03 6 0 "[ . 1 . 2]" 69 PSI 1 58 ASP N 1 58 ASP CA 1 58 ASP C 1 59 SER N 114.20 -153.80 171.42 163.64 -170.06 . . 0 "[ . 1 . 2]" 70 PHI 1 58 ASP C 1 59 SER N 1 59 SER CA 1 59 SER C -78.30 -38.30 -62.92 -59.49 -62.89 . . 0 "[ . 1 . 2]" 71 PSI 1 59 SER N 1 59 SER CA 1 59 SER C 1 60 LEU N -58.70 -18.70 -33.85 -46.74 -23.79 . . 0 "[ . 1 . 2]" 72 PHI 1 59 SER C 1 60 LEU N 1 60 LEU CA 1 60 LEU C -84.10 -44.10 -67.84 -75.99 -63.68 . . 0 "[ . 1 . 2]" 73 PSI 1 60 LEU N 1 60 LEU CA 1 60 LEU C 1 61 LEU N -62.90 -22.90 -46.03 -42.47 -44.38 . . 0 "[ . 1 . 2]" 74 PHI 1 60 LEU C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -87.20 -47.20 -64.53 -67.93 -61.00 . . 0 "[ . 1 . 2]" 75 PSI 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 ALA N -60.60 -20.60 -33.48 -37.57 -26.54 . . 0 "[ . 1 . 2]" 76 PHI 1 61 LEU C 1 62 ALA N 1 62 ALA CA 1 62 ALA C -84.80 -44.80 -68.84 -75.81 -62.38 . . 0 "[ . 1 . 2]" 77 PSI 1 62 ALA N 1 62 ALA CA 1 62 ALA C 1 63 THR N -59.30 -19.30 -35.11 -33.82 -35.51 . . 0 "[ . 1 . 2]" 78 PHI 1 62 ALA C 1 63 THR N 1 63 THR CA 1 63 THR C -83.90 -43.90 -65.07 -69.54 -59.93 . . 0 "[ . 1 . 2]" 79 PSI 1 63 THR N 1 63 THR CA 1 63 THR C 1 64 ARG N -62.90 -22.90 -35.06 -37.69 -39.00 . . 0 "[ . 1 . 2]" 80 PHI 1 63 THR C 1 64 ARG N 1 64 ARG CA 1 64 ARG C -84.70 -44.70 -73.38 -67.57 -69.12 0.04 9 0 "[ . 1 . 2]" 81 PSI 1 64 ARG N 1 64 ARG CA 1 64 ARG C 1 65 LEU N -61.90 -21.90 -40.06 -50.56 -27.36 . . 0 "[ . 1 . 2]" 82 PHI 1 64 ARG C 1 65 LEU N 1 65 LEU CA 1 65 LEU C -85.20 -45.20 -62.98 -56.38 -58.53 . . 0 "[ . 1 . 2]" 83 PSI 1 65 LEU N 1 65 LEU CA 1 65 LEU C 1 66 THR N -60.80 -20.80 -44.66 -52.65 -29.82 . . 0 "[ . 1 . 2]" 84 PHI 1 65 LEU C 1 66 THR N 1 66 THR CA 1 66 THR C -83.20 -43.20 -61.49 -68.00 -55.16 . . 0 "[ . 1 . 2]" 85 PSI 1 66 THR N 1 66 THR CA 1 66 THR C 1 67 GLY N -62.10 -22.10 -34.99 -30.19 -31.75 . . 0 "[ . 1 . 2]" 86 PHI 1 66 THR C 1 67 GLY N 1 67 GLY CA 1 67 GLY C -84.60 -44.60 -60.05 -67.79 -50.92 . . 0 "[ . 1 . 2]" 87 PSI 1 67 GLY N 1 67 GLY CA 1 67 GLY C 1 68 GLN N -61.90 -21.90 -38.96 -42.67 -51.43 . . 0 "[ . 1 . 2]" 88 PHI 1 67 GLY C 1 68 GLN N 1 68 GLN CA 1 68 GLN C -86.70 -46.70 -63.38 -68.32 -58.56 . . 0 "[ . 1 . 2]" 89 PSI 1 68 GLN N 1 68 GLN CA 1 68 GLN C 1 69 LEU N -59.10 -19.10 -36.65 -49.16 -22.77 . . 0 "[ . 1 . 2]" 90 PHI 1 68 GLN C 1 69 LEU N 1 69 LEU CA 1 69 LEU C -85.10 -45.10 -70.46 -67.44 -68.80 1.84 16 0 "[ . 1 . 2]" 91 PSI 1 69 LEU N 1 69 LEU CA 1 69 LEU C 1 70 HIS N -59.30 -19.30 -35.00 -41.76 -28.88 . . 0 "[ . 1 . 2]" 92 PHI 1 69 LEU C 1 70 HIS N 1 70 HIS CA 1 70 HIS C -85.50 -45.50 -60.89 -58.19 -59.57 . . 0 "[ . 1 . 2]" 93 PSI 1 70 HIS N 1 70 HIS CA 1 70 HIS C 1 71 GLN N -56.70 -16.70 -40.04 -41.63 -43.82 . . 0 "[ . 1 . 2]" 94 PHI 1 70 HIS C 1 71 GLN N 1 71 GLN CA 1 71 GLN C -87.00 -47.00 -72.08 -82.62 -66.48 . . 0 "[ . 1 . 2]" 95 PSI 1 71 GLN N 1 71 GLN CA 1 71 GLN C 1 72 ALA N -44.20 -4.20 -25.73 -25.24 -26.86 . . 0 "[ . 1 . 2]" 96 PHI 1 71 GLN C 1 72 ALA N 1 72 ALA CA 1 72 ALA C -103.80 -63.80 -81.32 -95.20 -72.22 . . 0 "[ . 1 . 2]" 97 PSI 1 72 ALA N 1 72 ALA CA 1 72 ALA C 1 73 GLY N -23.10 16.90 -6.74 -12.73 -13.63 0.77 4 0 "[ . 1 . 2]" 98 PHI 1 72 ALA C 1 73 GLY N 1 73 GLY CA 1 73 GLY C 71.20 111.20 85.97 76.58 106.83 . . 0 "[ . 1 . 2]" 99 PSI 1 73 GLY N 1 73 GLY CA 1 73 GLY C 1 74 TYR N -6.90 33.10 28.43 30.45 28.47 2.66 14 0 "[ . 1 . 2]" 100 PHI 1 73 GLY C 1 74 TYR N 1 74 TYR CA 1 74 TYR C -118.80 -69.30 -120.17 -122.78 -123.16 4.52 4 0 "[ . 1 . 2]" 101 PSI 1 74 TYR N 1 74 TYR CA 1 74 TYR C 1 75 GLU N 128.40 168.40 128.46 122.38 137.71 6.02 13 1 "[ . 1 + . 2]" 102 PHI 1 74 TYR C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -101.10 -58.70 -78.30 -89.33 -72.80 . . 0 "[ . 1 . 2]" 103 PSI 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 ALA N 109.90 149.90 126.26 124.89 120.06 3.33 13 0 "[ . 1 . 2]" 104 PHI 1 75 GLU C 1 76 ALA N 1 76 ALA CA 1 76 ALA C -155.00 -106.80 -142.18 -155.98 -108.49 0.98 18 0 "[ . 1 . 2]" 105 PSI 1 76 ALA N 1 76 ALA CA 1 76 ALA C 1 77 GLN N 113.60 165.20 130.54 127.26 126.50 1.55 3 0 "[ . 1 . 2]" 106 PHI 1 76 ALA C 1 77 GLN N 1 77 GLN CA 1 77 GLN C -133.60 -74.10 -121.87 -136.03 -90.82 2.43 6 0 "[ . 1 . 2]" 107 PSI 1 77 GLN N 1 77 GLN CA 1 77 GLN C 1 78 LEU N 95.20 159.90 157.19 162.76 162.24 4.42 2 0 "[ . 1 . 2]" 108 PHI 1 77 GLN C 1 78 LEU N 1 78 LEU CA 1 78 LEU C -76.30 -36.30 -60.35 -55.04 -57.54 . . 0 "[ . 1 . 2]" 109 PSI 1 78 LEU N 1 78 LEU CA 1 78 LEU C 1 79 SER N -60.80 -20.80 -33.28 -36.74 -38.44 . . 0 "[ . 1 . 2]" 110 PHI 1 78 LEU C 1 79 SER N 1 79 SER CA 1 79 SER C -83.80 -43.80 -57.24 -68.88 -47.18 . . 0 "[ . 1 . 2]" 111 PSI 1 79 SER N 1 79 SER CA 1 79 SER C 1 80 ASP N -55.10 -15.10 -38.41 -35.60 -37.48 . . 0 "[ . 1 . 2]" 112 PHI 1 79 SER C 1 80 ASP N 1 80 ASP CA 1 80 ASP C -89.90 -49.90 -74.37 -68.93 -69.70 0.99 4 0 "[ . 1 . 2]" 113 PSI 1 80 ASP N 1 80 ASP CA 1 80 ASP C 1 81 LEU N -56.80 -16.80 -35.11 -57.17 -13.98 2.82 12 0 "[ . 1 . 2]" 114 PHI 1 80 ASP C 1 81 LEU N 1 81 LEU CA 1 81 LEU C -87.30 -47.30 -70.31 -67.98 -69.80 . . 0 "[ . 1 . 2]" 115 PSI 1 81 LEU N 1 81 LEU CA 1 81 LEU C 1 82 PHE N -61.90 -21.90 -35.00 -34.45 -35.07 . . 0 "[ . 1 . 2]" 116 PHI 1 81 LEU C 1 82 PHE N 1 82 PHE CA 1 82 PHE C -87.20 -47.20 -79.10 -87.61 -64.66 0.41 6 0 "[ . 1 . 2]" 117 PSI 1 82 PHE N 1 82 PHE CA 1 82 PHE C 1 83 ASN N -46.20 -6.20 -33.87 -12.42 -22.26 0.66 13 0 "[ . 1 . 2]" 118 PHI 1 82 PHE C 1 83 ASN N 1 83 ASN CA 1 83 ASN C -100.20 -60.20 -80.77 -100.28 -66.93 0.08 2 0 "[ . 1 . 2]" 119 PSI 1 83 ASN N 1 83 ASN CA 1 83 ASN C 1 84 HIS N -29.90 10.10 -29.99 -24.11 -29.27 3.59 17 0 "[ . 1 . 2]" 120 PSI 1 85 PRO N 1 85 PRO CA 1 85 PRO C 1 86 ARG N -50.50 -9.10 -32.09 -30.05 -31.52 . . 0 "[ . 1 . 2]" 121 PHI 1 86 ARG C 1 87 LEU N 1 87 LEU CA 1 87 LEU C -81.50 -41.50 -61.20 -62.53 -63.27 . . 0 "[ . 1 . 2]" 122 PSI 1 87 LEU N 1 87 LEU CA 1 87 LEU C 1 88 ALA N -64.50 -24.50 -53.65 -65.08 -41.73 0.58 2 0 "[ . 1 . 2]" 123 PHI 1 87 LEU C 1 88 ALA N 1 88 ALA CA 1 88 ALA C -84.10 -44.10 -70.90 -82.30 -61.00 . . 0 "[ . 1 . 2]" 124 PSI 1 88 ALA N 1 88 ALA CA 1 88 ALA C 1 89 ASP N -59.30 -19.30 -30.72 -19.15 -21.35 1.38 17 0 "[ . 1 . 2]" 125 PHI 1 88 ALA C 1 89 ASP N 1 89 ASP CA 1 89 ASP C -88.30 -48.30 -71.53 -71.25 -72.00 . . 0 "[ . 1 . 2]" 126 PSI 1 89 ASP N 1 89 ASP CA 1 89 ASP C 1 90 PHE N -59.90 -19.90 -35.86 -45.00 -28.23 . . 0 "[ . 1 . 2]" 127 PHI 1 89 ASP C 1 90 PHE N 1 90 PHE CA 1 90 PHE C -83.20 -43.20 -73.63 -74.94 -75.66 0.73 17 0 "[ . 1 . 2]" 128 PSI 1 90 PHE N 1 90 PHE CA 1 90 PHE C 1 91 ALA N -63.50 -23.50 -39.00 -36.26 -36.99 . . 0 "[ . 1 . 2]" 129 PHI 1 90 PHE C 1 91 ALA N 1 91 ALA CA 1 91 ALA C -83.20 -43.20 -65.69 -73.44 -60.08 . . 0 "[ . 1 . 2]" 130 PSI 1 91 ALA N 1 91 ALA CA 1 91 ALA C 1 92 ALA N -54.00 -14.00 -32.37 -45.58 -19.75 . . 0 "[ . 1 . 2]" 131 PHI 1 91 ALA C 1 92 ALA N 1 92 ALA CA 1 92 ALA C -89.50 -49.50 -72.38 -81.76 -66.07 . . 0 "[ . 1 . 2]" 132 PSI 1 92 ALA N 1 92 ALA CA 1 92 ALA C 1 93 THR N -38.50 1.50 -31.62 -20.69 -27.04 1.18 18 0 "[ . 1 . 2]" 133 PHI 1 92 ALA C 1 93 THR N 1 93 THR CA 1 93 THR C -110.20 -70.20 -87.64 -106.00 -74.12 . . 0 "[ . 1 . 2]" 134 PSI 1 93 THR N 1 93 THR CA 1 93 THR C 1 94 LEU N -29.30 12.60 -5.13 -8.20 -9.64 3.09 17 0 "[ . 1 . 2]" 135 PHI 1 93 THR C 1 94 LEU N 1 94 LEU CA 1 94 LEU C -91.80 -51.80 -73.46 -85.93 -63.13 . . 0 "[ . 1 . 2]" 136 PSI 1 94 LEU N 1 94 LEU CA 1 94 LEU C 1 95 ARG N 122.00 163.30 134.86 118.19 155.38 3.81 19 0 "[ . 1 . 2]" 137 PHI 1 94 LEU C 1 95 ARG N 1 95 ARG CA 1 95 ARG C -158.90 -96.30 -113.49 -102.44 -104.12 . . 0 "[ . 1 . 2]" 138 PSI 1 95 ARG N 1 95 ARG CA 1 95 ARG C 1 96 LYS N 114.50 168.90 148.24 156.81 147.56 5.13 17 1 "[ . 1 . + 2]" 139 PHI 1 95 ARG C 1 96 LYS N 1 96 LYS CA 1 96 LYS C -90.20 -50.20 -75.03 -94.43 -60.19 4.23 5 0 "[ . 1 . 2]" 140 PSI 1 96 LYS N 1 96 LYS CA 1 96 LYS C 1 97 THR N 107.40 166.00 128.11 114.06 110.19 1.34 12 0 "[ . 1 . 2]" 141 PHI 1 96 LYS C 1 97 THR N 1 97 THR CA 1 97 THR C -93.80 -49.90 -75.11 -94.94 -55.38 1.14 17 0 "[ . 1 . 2]" 142 PSI 1 97 THR N 1 97 THR CA 1 97 THR C 1 98 ASP N 120.70 170.60 143.10 140.65 139.24 . . 0 "[ . 1 . 2]" 143 PHI 1 97 THR C 1 98 ASP N 1 98 ASP CA 1 98 ASP C -92.10 -52.10 -65.17 -78.61 -51.99 0.11 8 0 "[ . 1 . 2]" 144 PSI 1 98 ASP N 1 98 ASP CA 1 98 ASP C 1 99 VAL N 105.70 165.50 122.97 109.65 109.14 2.35 6 0 "[ . 1 . 2]" 145 PHI 1 98 ASP C 1 99 VAL N 1 99 VAL CA 1 99 VAL C -127.10 -63.50 -70.65 -94.34 -61.64 1.86 8 0 "[ . 1 . 2]" 146 PSI 1 99 VAL N 1 99 VAL CA 1 99 VAL C 1 100 PRO N 100.00 169.60 131.74 98.85 161.12 1.15 19 0 "[ . 1 . 2]" stop_ save_
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