NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
430522 | 2joe | 15167 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2joe save_distance_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 161 _TA_constraint_stats_list.Viol_count 119 _TA_constraint_stats_list.Viol_total 390.85 _TA_constraint_stats_list.Viol_max 0.48 _TA_constraint_stats_list.Viol_rms 0.04 _TA_constraint_stats_list.Viol_average_all_restraints 0.01 _TA_constraint_stats_list.Viol_average_violations_only 0.16 _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 5 GLU C 1 6 GLU N 1 6 GLU CA 1 6 GLU C -157.44 -97.44 -108.33 -146.02 -97.15 0.29 17 0 "[ . 1 . 2]" 2 . 1 6 GLU N 1 6 GLU CA 1 6 GLU C 1 7 SER N 113.18 -166.82 138.45 149.34 145.53 . . 0 "[ . 1 . 2]" 3 . 1 6 GLU C 1 7 SER N 1 7 SER CA 1 7 SER C -151.75 -91.75 -108.65 -137.27 -95.45 . . 0 "[ . 1 . 2]" 4 . 1 7 SER N 1 7 SER CA 1 7 SER C 1 8 LYS N 111.88 -168.12 123.61 133.62 131.36 0.19 8 0 "[ . 1 . 2]" 5 . 1 7 SER C 1 8 LYS N 1 8 LYS CA 1 8 LYS C -173.18 -113.18 -119.91 -144.43 -112.78 0.40 12 0 "[ . 1 . 2]" 6 . 1 8 LYS N 1 8 LYS CA 1 8 LYS C 1 9 LYS N 94.88 174.88 112.11 94.44 132.56 0.44 12 0 "[ . 1 . 2]" 7 . 1 8 LYS C 1 9 LYS N 1 9 LYS CA 1 9 LYS C -148.58 -88.58 -104.48 -101.92 -105.07 . . 0 "[ . 1 . 2]" 8 . 1 9 LYS N 1 9 LYS CA 1 9 LYS C 1 10 PHE N 96.02 176.02 127.75 117.85 116.00 . . 0 "[ . 1 . 2]" 9 . 1 9 LYS C 1 10 PHE N 1 10 PHE CA 1 10 PHE C -154.48 -94.48 -121.29 -107.33 -109.54 . . 0 "[ . 1 . 2]" 10 . 1 10 PHE N 1 10 PHE CA 1 10 PHE C 1 11 SER N 104.37 -175.63 152.63 139.86 167.11 . . 0 "[ . 1 . 2]" 11 . 1 10 PHE C 1 11 SER N 1 11 SER CA 1 11 SER C -170.51 -110.51 -144.73 -137.86 -142.86 . . 0 "[ . 1 . 2]" 12 . 1 11 SER N 1 11 SER CA 1 11 SER C 1 12 ALA N 106.44 -173.56 118.98 114.68 107.75 0.24 12 0 "[ . 1 . 2]" 13 . 1 11 SER C 1 12 ALA N 1 12 ALA CA 1 12 ALA C -168.14 -108.14 -122.45 -141.97 -108.02 0.12 6 0 "[ . 1 . 2]" 14 . 1 12 ALA N 1 12 ALA CA 1 12 ALA C 1 13 ASN N 102.43 -177.57 121.86 119.10 115.68 . . 0 "[ . 1 . 2]" 15 . 1 12 ALA C 1 13 ASN N 1 13 ASN CA 1 13 ASN C -131.13 -71.13 -89.55 -90.88 -92.21 . . 0 "[ . 1 . 2]" 16 . 1 13 ASN N 1 13 ASN CA 1 13 ASN C 1 14 LEU N 87.83 167.83 100.52 99.13 98.29 0.01 6 0 "[ . 1 . 2]" 17 . 1 16 GLY C 1 17 THR N 1 17 THR CA 1 17 THR C -136.63 -76.63 -110.72 -97.67 -107.56 0.03 17 0 "[ . 1 . 2]" 18 . 1 17 THR N 1 17 THR CA 1 17 THR C 1 18 GLU N 96.61 176.61 120.77 98.62 146.04 . . 0 "[ . 1 . 2]" 19 . 1 18 GLU C 1 19 ILE N 1 19 ILE CA 1 19 ILE C -151.09 -91.09 -95.47 -93.32 -93.90 0.41 14 0 "[ . 1 . 2]" 20 . 1 19 ILE N 1 19 ILE CA 1 19 ILE C 1 20 ALA N 89.91 169.91 107.52 115.26 110.29 . . 0 "[ . 1 . 2]" 21 . 1 19 ILE C 1 20 ALA N 1 20 ALA CA 1 20 ALA C -144.63 -84.63 -113.32 -116.55 -118.80 . . 0 "[ . 1 . 2]" 22 . 1 20 ALA N 1 20 ALA CA 1 20 ALA C 1 21 ILE N 88.29 168.29 105.39 92.73 115.73 . . 0 "[ . 1 . 2]" 23 . 1 20 ALA C 1 21 ILE N 1 21 ILE CA 1 21 ILE C -153.72 -93.72 -104.07 -118.30 -93.56 0.16 10 0 "[ . 1 . 2]" 24 . 1 21 ILE N 1 21 ILE CA 1 21 ILE C 1 22 THR N 88.16 168.16 118.28 124.41 120.22 . . 0 "[ . 1 . 2]" 25 . 1 21 ILE C 1 22 THR N 1 22 THR CA 1 22 THR C -145.85 -85.85 -103.33 -115.66 -92.08 . . 0 "[ . 1 . 2]" 26 . 1 22 THR N 1 22 THR CA 1 22 THR C 1 23 TYR N 87.80 167.80 98.92 93.72 90.24 . . 0 "[ . 1 . 2]" 27 . 1 22 THR C 1 23 TYR N 1 23 TYR CA 1 23 TYR C -141.63 -81.63 -94.91 -88.69 -91.47 0.34 7 0 "[ . 1 . 2]" 28 . 1 23 TYR N 1 23 TYR CA 1 23 TYR C 1 24 VAL N 92.84 172.84 123.77 102.34 147.05 . . 0 "[ . 1 . 2]" 29 . 1 23 TYR C 1 24 VAL N 1 24 VAL CA 1 24 VAL C -145.87 -85.87 -96.91 -92.10 -93.55 . . 0 "[ . 1 . 2]" 30 . 1 24 VAL N 1 24 VAL CA 1 24 VAL C 1 25 TYR N 87.79 167.79 114.42 95.50 127.14 . . 0 "[ . 1 . 2]" 31 . 1 24 VAL C 1 25 TYR N 1 25 TYR CA 1 25 TYR C -169.64 -109.64 -119.04 -132.97 -109.55 0.09 3 0 "[ . 1 . 2]" 32 . 1 25 TYR N 1 25 TYR CA 1 25 TYR C 1 26 LYS N 114.32 -165.68 154.11 161.21 158.90 . . 0 "[ . 1 . 2]" 33 . 1 25 TYR C 1 26 LYS N 1 26 LYS CA 1 26 LYS C -143.84 -83.84 -129.99 -143.92 -113.60 0.08 13 0 "[ . 1 . 2]" 34 . 1 26 LYS N 1 26 LYS CA 1 26 LYS C 1 27 GLY N 83.27 163.27 102.80 115.23 113.29 . . 0 "[ . 1 . 2]" 35 . 1 26 LYS C 1 27 GLY N 1 27 GLY CA 1 27 GLY C 23.68 83.68 80.00 68.18 83.83 0.15 3 0 "[ . 1 . 2]" 36 . 1 27 GLY N 1 27 GLY CA 1 27 GLY C 1 28 ASP N 163.93 -116.07 -118.67 -141.41 -115.62 0.45 13 0 "[ . 1 . 2]" 37 . 1 29 LYS C 1 30 VAL N 1 30 VAL CA 1 30 VAL C -115.47 -55.47 -80.75 -74.44 -76.16 . . 0 "[ . 1 . 2]" 38 . 1 30 VAL N 1 30 VAL CA 1 30 VAL C 1 31 LEU N 88.84 168.84 119.91 94.28 135.75 . . 0 "[ . 1 . 2]" 39 . 1 31 LEU C 1 32 LYS N 1 32 LYS CA 1 32 LYS C -172.82 -112.82 -142.04 -134.91 -135.50 0.31 15 0 "[ . 1 . 2]" 40 . 1 32 LYS N 1 32 LYS CA 1 32 LYS C 1 33 GLN N 117.02 -162.98 128.98 116.57 164.13 0.45 15 0 "[ . 1 . 2]" 41 . 1 32 LYS C 1 33 GLN N 1 33 GLN CA 1 33 GLN C -167.49 -107.49 -117.89 -144.34 -107.20 0.29 14 0 "[ . 1 . 2]" 42 . 1 33 GLN N 1 33 GLN CA 1 33 GLN C 1 34 SER N 92.48 172.48 107.67 106.85 105.33 0.07 14 0 "[ . 1 . 2]" 43 . 1 33 GLN C 1 34 SER N 1 34 SER CA 1 34 SER C -145.23 -85.23 -92.92 -140.30 -85.29 . . 0 "[ . 1 . 2]" 44 . 1 34 SER N 1 34 SER CA 1 34 SER C 1 35 SER N 89.49 169.49 97.59 90.60 111.51 . . 0 "[ . 1 . 2]" 45 . 1 34 SER C 1 35 SER N 1 35 SER CA 1 35 SER C -157.62 -97.62 -99.81 -97.38 -97.44 0.48 6 0 "[ . 1 . 2]" 46 . 1 35 SER N 1 35 SER CA 1 35 SER C 1 36 GLU N 92.75 172.75 101.70 96.86 94.54 . . 0 "[ . 1 . 2]" 47 . 1 35 SER C 1 36 GLU N 1 36 GLU CA 1 36 GLU C -154.44 -94.44 -105.67 -122.38 -94.61 . . 0 "[ . 1 . 2]" 48 . 1 36 GLU N 1 36 GLU CA 1 36 GLU C 1 37 THR N 87.42 167.42 110.91 107.54 107.26 . . 0 "[ . 1 . 2]" 49 . 1 36 GLU C 1 37 THR N 1 37 THR CA 1 37 THR C -147.47 -87.47 -100.01 -99.70 -102.04 0.29 2 0 "[ . 1 . 2]" 50 . 1 37 THR N 1 37 THR CA 1 37 THR C 1 38 LYS N 86.53 166.53 111.89 100.69 136.98 . . 0 "[ . 1 . 2]" 51 . 1 37 THR C 1 38 LYS N 1 38 LYS CA 1 38 LYS C -142.18 -82.18 -90.56 -83.71 -86.32 0.11 19 0 "[ . 1 . 2]" 52 . 1 38 LYS N 1 38 LYS CA 1 38 LYS C 1 39 ILE N 84.19 164.19 102.16 86.52 114.61 . . 0 "[ . 1 . 2]" 53 . 1 38 LYS C 1 39 ILE N 1 39 ILE CA 1 39 ILE C -144.37 -84.37 -97.74 -115.21 -86.86 . . 0 "[ . 1 . 2]" 54 . 1 39 ILE N 1 39 ILE CA 1 39 ILE C 1 40 GLN N 85.98 165.98 121.25 103.88 134.89 . . 0 "[ . 1 . 2]" 55 . 1 48 THR C 1 49 LYS N 1 49 LYS CA 1 49 LYS C -92.56 -32.56 -65.01 -76.98 -52.57 . . 0 "[ . 1 . 2]" 56 . 1 49 LYS N 1 49 LYS CA 1 49 LYS C 1 50 GLU N -74.59 5.41 -32.02 -26.56 -29.53 . . 0 "[ . 1 . 2]" 57 . 1 49 LYS C 1 50 GLU N 1 50 GLU CA 1 50 GLU C -94.95 -34.95 -65.39 -79.91 -52.66 . . 0 "[ . 1 . 2]" 58 . 1 50 GLU N 1 50 GLU CA 1 50 GLU C 1 51 ASP N -80.34 -0.34 -44.10 -51.73 -52.43 . . 0 "[ . 1 . 2]" 59 . 1 50 GLU C 1 51 ASP N 1 51 ASP CA 1 51 ASP C -95.56 -35.56 -64.09 -61.34 -62.41 . . 0 "[ . 1 . 2]" 60 . 1 51 ASP N 1 51 ASP CA 1 51 ASP C 1 52 ALA N -78.51 1.49 -36.05 -48.38 -16.00 . . 0 "[ . 1 . 2]" 61 . 1 51 ASP C 1 52 ALA N 1 52 ALA CA 1 52 ALA C -91.61 -31.61 -65.84 -65.18 -65.34 . . 0 "[ . 1 . 2]" 62 . 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 ALA N -79.59 0.41 -46.55 -54.39 -35.40 . . 0 "[ . 1 . 2]" 63 . 1 52 ALA C 1 53 ALA N 1 53 ALA CA 1 53 ALA C -95.27 -35.27 -61.61 -61.70 -61.92 . . 0 "[ . 1 . 2]" 64 . 1 53 ALA N 1 53 ALA CA 1 53 ALA C 1 54 LYS N -78.72 1.28 -44.25 -53.82 -38.67 . . 0 "[ . 1 . 2]" 65 . 1 53 ALA C 1 54 LYS N 1 54 LYS CA 1 54 LYS C -93.85 -33.85 -58.99 -61.64 -62.13 . . 0 "[ . 1 . 2]" 66 . 1 54 LYS N 1 54 LYS CA 1 54 LYS C 1 55 THR N -80.71 -0.71 -20.65 -34.77 -8.27 . . 0 "[ . 1 . 2]" 67 . 1 54 LYS C 1 55 THR N 1 55 THR CA 1 55 THR C -99.11 -39.11 -97.67 -95.73 -96.77 0.38 9 0 "[ . 1 . 2]" 68 . 1 55 THR N 1 55 THR CA 1 55 THR C 1 56 LEU N -79.55 0.45 -40.61 -49.68 -33.55 . . 0 "[ . 1 . 2]" 69 . 1 55 THR C 1 56 LEU N 1 56 LEU CA 1 56 LEU C -93.22 -33.22 -87.23 -93.38 -79.72 0.16 3 0 "[ . 1 . 2]" 70 . 1 56 LEU N 1 56 LEU CA 1 56 LEU C 1 57 GLU N -78.05 1.95 -30.14 -39.28 -44.10 . . 0 "[ . 1 . 2]" 71 . 1 56 LEU C 1 57 GLU N 1 57 GLU CA 1 57 GLU C -97.63 -37.63 -55.92 -71.39 -47.37 . . 0 "[ . 1 . 2]" 72 . 1 57 GLU N 1 57 GLU CA 1 57 GLU C 1 58 PRO N -81.29 -1.29 -51.18 -45.71 -48.45 . . 0 "[ . 1 . 2]" 73 . 1 58 PRO N 1 58 PRO CA 1 58 PRO C 1 59 LEU N -76.52 3.48 -22.32 -40.82 -5.45 . . 0 "[ . 1 . 2]" 74 . 1 58 PRO C 1 59 LEU N 1 59 LEU CA 1 59 LEU C -98.38 -38.38 -80.40 -76.00 -80.39 . . 0 "[ . 1 . 2]" 75 . 1 59 LEU N 1 59 LEU CA 1 59 LEU C 1 60 SER N -73.94 6.06 -48.89 -42.39 -44.20 . . 0 "[ . 1 . 2]" 76 . 1 59 LEU C 1 60 SER N 1 60 SER CA 1 60 SER C -94.92 -34.92 -66.75 -61.31 -63.46 . . 0 "[ . 1 . 2]" 77 . 1 60 SER N 1 60 SER CA 1 60 SER C 1 61 ALA N -81.88 -1.88 -24.99 -22.71 -25.16 . . 0 "[ . 1 . 2]" 78 . 1 60 SER C 1 61 ALA N 1 61 ALA CA 1 61 ALA C -93.41 -33.41 -68.18 -72.62 -75.07 . . 0 "[ . 1 . 2]" 79 . 1 61 ALA N 1 61 ALA CA 1 61 ALA C 1 62 LYS N -77.35 2.65 -6.99 -24.73 2.58 . . 0 "[ . 1 . 2]" 80 . 1 61 ALA C 1 62 LYS N 1 62 LYS CA 1 62 LYS C -98.02 -38.02 -74.42 -89.88 -59.12 . . 0 "[ . 1 . 2]" 81 . 1 62 LYS N 1 62 LYS CA 1 62 LYS C 1 63 TYR N -74.36 5.64 -25.37 -44.04 0.58 . . 0 "[ . 1 . 2]" 82 . 1 62 LYS C 1 63 TYR N 1 63 TYR CA 1 63 TYR C -122.05 -62.05 -83.02 -114.24 -64.19 . . 0 "[ . 1 . 2]" 83 . 1 63 TYR N 1 63 TYR CA 1 63 TYR C 1 64 LYS N -57.60 22.40 -26.87 -37.76 -48.45 0.34 20 0 "[ . 1 . 2]" 84 . 1 68 GLY C 1 69 VAL N 1 69 VAL CA 1 69 VAL C -142.07 -82.07 -91.71 -86.90 -89.38 0.30 18 0 "[ . 1 . 2]" 85 . 1 69 VAL N 1 69 VAL CA 1 69 VAL C 1 70 GLU N 98.90 178.90 111.85 108.05 104.95 0.00 20 0 "[ . 1 . 2]" 86 . 1 69 VAL C 1 70 GLU N 1 70 GLU CA 1 70 GLU C -153.32 -93.32 -105.78 -134.28 -93.34 . . 0 "[ . 1 . 2]" 87 . 1 70 GLU N 1 70 GLU CA 1 70 GLU C 1 71 GLU N 92.64 172.64 117.79 140.79 130.84 . . 0 "[ . 1 . 2]" 88 . 1 70 GLU C 1 71 GLU N 1 71 GLU CA 1 71 GLU C -140.61 -80.61 -102.46 -110.47 -117.49 . . 0 "[ . 1 . 2]" 89 . 1 71 GLU N 1 71 GLU CA 1 71 GLU C 1 72 LYS N 93.98 173.98 109.07 107.21 101.90 0.21 15 0 "[ . 1 . 2]" 90 . 1 71 GLU C 1 72 LYS N 1 72 LYS CA 1 72 LYS C -160.11 -100.11 -113.55 -101.80 -104.90 0.19 16 0 "[ . 1 . 2]" 91 . 1 72 LYS N 1 72 LYS CA 1 72 LYS C 1 73 LEU N 96.27 176.27 104.54 104.85 103.65 0.08 7 0 "[ . 1 . 2]" 92 . 1 72 LYS C 1 73 LEU N 1 73 LEU CA 1 73 LEU C -141.13 -81.13 -88.09 -102.93 -80.83 0.30 8 0 "[ . 1 . 2]" 93 . 1 73 LEU N 1 73 LEU CA 1 73 LEU C 1 74 THR N 98.81 178.81 107.22 124.75 115.42 0.11 18 0 "[ . 1 . 2]" 94 . 1 73 LEU C 1 74 THR N 1 74 THR CA 1 74 THR C -161.74 -101.74 -105.96 -119.53 -101.27 0.47 5 0 "[ . 1 . 2]" 95 . 1 74 THR N 1 74 THR CA 1 74 THR C 1 75 TYR N 109.13 -170.87 113.63 117.61 115.48 0.31 8 0 "[ . 1 . 2]" 96 . 1 74 THR C 1 75 TYR N 1 75 TYR CA 1 75 TYR C -144.96 -84.96 -105.01 -119.87 -143.35 0.24 9 0 "[ . 1 . 2]" 97 . 1 75 TYR N 1 75 TYR CA 1 75 TYR C 1 76 THR N 102.33 -177.67 117.47 102.06 138.58 0.27 5 0 "[ . 1 . 2]" 98 . 1 79 TYR C 1 80 ALA N 1 80 ALA CA 1 80 ALA C -160.14 -100.14 -122.21 -135.80 -106.74 . . 0 "[ . 1 . 2]" 99 . 1 80 ALA N 1 80 ALA CA 1 80 ALA C 1 81 GLN N 104.01 -175.99 127.03 117.60 110.77 . . 0 "[ . 1 . 2]" 100 . 1 80 ALA C 1 81 GLN N 1 81 GLN CA 1 81 GLN C -158.13 -98.13 -102.81 -117.27 -97.93 0.20 18 0 "[ . 1 . 2]" 101 . 1 81 GLN N 1 81 GLN CA 1 81 GLN C 1 82 GLU N 90.39 170.39 113.93 110.21 108.77 . . 0 "[ . 1 . 2]" 102 . 1 81 GLN C 1 82 GLU N 1 82 GLU CA 1 82 GLU C -144.02 -84.02 -88.00 -87.34 -88.22 0.39 12 0 "[ . 1 . 2]" 103 . 1 82 GLU N 1 82 GLU CA 1 82 GLU C 1 83 ASN N 79.90 159.90 90.40 79.66 108.42 0.24 18 0 "[ . 1 . 2]" 104 . 1 82 GLU C 1 83 ASN N 1 83 ASN CA 1 83 ASN C -138.82 -78.82 -84.36 -105.85 -78.56 0.26 12 0 "[ . 1 . 2]" 105 . 1 83 ASN N 1 83 ASN CA 1 83 ASN C 1 84 VAL N 88.43 168.43 99.57 89.80 106.83 . . 0 "[ . 1 . 2]" 106 . 1 83 ASN C 1 84 VAL N 1 84 VAL CA 1 84 VAL C -147.14 -87.14 -104.41 -98.52 -100.15 . . 0 "[ . 1 . 2]" 107 . 1 84 VAL N 1 84 VAL CA 1 84 VAL C 1 85 THR N 90.29 170.29 122.57 101.56 147.37 . . 0 "[ . 1 . 2]" 108 . 1 84 VAL C 1 85 THR N 1 85 THR CA 1 85 THR C -150.59 -90.59 -108.61 -112.59 -122.04 . . 0 "[ . 1 . 2]" 109 . 1 85 THR N 1 85 THR CA 1 85 THR C 1 86 ILE N 83.20 163.20 107.01 102.77 101.78 . . 0 "[ . 1 . 2]" 110 . 1 85 THR C 1 86 ILE N 1 86 ILE CA 1 86 ILE C -153.23 -93.23 -101.43 -138.04 -92.75 0.48 6 0 "[ . 1 . 2]" 111 . 1 86 ILE N 1 86 ILE CA 1 86 ILE C 1 87 ASP N 92.41 172.41 114.55 122.83 114.65 . . 0 "[ . 1 . 2]" 112 . 1 86 ILE C 1 87 ASP N 1 87 ASP CA 1 87 ASP C -120.22 -60.22 -82.63 -110.97 -68.32 . . 0 "[ . 1 . 2]" 113 . 1 87 ASP N 1 87 ASP CA 1 87 ASP C 1 88 MET N 82.71 162.71 118.77 106.67 162.85 0.14 9 0 "[ . 1 . 2]" 114 . 1 92 ASP C 1 93 PHE N 1 93 PHE CA 1 93 PHE C -90.16 -30.16 -70.42 -72.08 -73.88 . . 0 "[ . 1 . 2]" 115 . 1 93 PHE N 1 93 PHE CA 1 93 PHE C 1 94 LYS N -71.22 8.78 -13.87 -37.62 1.26 . . 0 "[ . 1 . 2]" 116 . 1 93 PHE C 1 94 LYS N 1 94 LYS CA 1 94 LYS C -95.29 -35.29 -70.75 -89.88 -57.65 . . 0 "[ . 1 . 2]" 117 . 1 94 LYS N 1 94 LYS CA 1 94 LYS C 1 95 ALA N -79.67 0.33 -45.17 -55.00 -57.97 . . 0 "[ . 1 . 2]" 118 . 1 94 LYS C 1 95 ALA N 1 95 ALA CA 1 95 ALA C -97.16 -37.16 -76.20 -90.71 -68.54 . . 0 "[ . 1 . 2]" 119 . 1 95 ALA N 1 95 ALA CA 1 95 ALA C 1 96 LEU N -83.92 -3.92 -31.80 -28.68 -29.59 . . 0 "[ . 1 . 2]" 120 . 1 95 ALA C 1 96 LEU N 1 96 LEU CA 1 96 LEU C -98.00 -38.00 -65.66 -83.58 -54.86 . . 0 "[ . 1 . 2]" 121 . 1 96 LEU N 1 96 LEU CA 1 96 LEU C 1 97 GLN N -78.99 1.01 -19.71 -27.24 -30.03 0.20 10 0 "[ . 1 . 2]" 122 . 1 96 LEU C 1 97 GLN N 1 97 GLN CA 1 97 GLN C -98.26 -38.26 -58.65 -62.66 -64.64 . . 0 "[ . 1 . 2]" 123 . 1 97 GLN N 1 97 GLN CA 1 97 GLN C 1 98 GLY N -75.30 4.70 -30.57 -51.92 -4.05 . . 0 "[ . 1 . 2]" 124 . 1 105 SER C 1 106 ALA N 1 106 ALA CA 1 106 ALA C -95.27 -35.27 -71.80 -95.43 -51.04 0.16 10 0 "[ . 1 . 2]" 125 . 1 106 ALA N 1 106 ALA CA 1 106 ALA C 1 107 GLU N -70.68 9.32 -24.14 -3.68 -17.21 . . 0 "[ . 1 . 2]" 126 . 1 108 ASP C 1 109 ALA N 1 109 ALA CA 1 109 ALA C -90.93 -30.93 -69.52 -86.42 -57.16 . . 0 "[ . 1 . 2]" 127 . 1 109 ALA N 1 109 ALA CA 1 109 ALA C 1 110 LYS N -84.23 -4.23 -31.18 -22.73 -27.63 . . 0 "[ . 1 . 2]" 128 . 1 109 ALA C 1 110 LYS N 1 110 LYS CA 1 110 LYS C -97.28 -37.28 -77.95 -97.35 -60.57 0.07 11 0 "[ . 1 . 2]" 129 . 1 110 LYS N 1 110 LYS CA 1 110 LYS C 1 111 LYS N -75.62 4.38 -22.98 -34.09 -36.71 . . 0 "[ . 1 . 2]" 130 . 1 112 GLY C 1 113 ILE N 1 113 ILE CA 1 113 ILE C -122.76 -62.76 -77.28 -110.04 -62.44 0.32 18 0 "[ . 1 . 2]" 131 . 1 113 ILE N 1 113 ILE CA 1 113 ILE C 1 114 THR N 104.46 -175.54 118.21 104.79 137.31 . . 0 "[ . 1 . 2]" 132 . 1 113 ILE C 1 114 THR N 1 114 THR CA 1 114 THR C -127.89 -67.89 -119.97 -128.22 -105.77 0.33 5 0 "[ . 1 . 2]" 133 . 1 114 THR N 1 114 THR CA 1 114 THR C 1 115 MET N 128.37 -151.63 176.81 168.66 155.46 . . 0 "[ . 1 . 2]" 134 . 1 114 THR C 1 115 MET N 1 115 MET CA 1 115 MET C -95.13 -35.13 -69.43 -78.78 -59.17 . . 0 "[ . 1 . 2]" 135 . 1 115 MET N 1 115 MET CA 1 115 MET C 1 116 ALA N -70.65 9.35 -40.07 -39.37 -40.28 . . 0 "[ . 1 . 2]" 136 . 1 115 MET C 1 116 ALA N 1 116 ALA CA 1 116 ALA C -92.71 -32.71 -57.35 -57.51 -58.88 . . 0 "[ . 1 . 2]" 137 . 1 116 ALA N 1 116 ALA CA 1 116 ALA C 1 117 GLN N -81.14 -1.14 -42.53 -53.19 -27.13 . . 0 "[ . 1 . 2]" 138 . 1 116 ALA C 1 117 GLN N 1 117 GLN CA 1 117 GLN C -94.15 -34.15 -59.33 -59.47 -63.64 . . 0 "[ . 1 . 2]" 139 . 1 117 GLN N 1 117 GLN CA 1 117 GLN C 1 118 MET N -80.53 -0.53 -65.31 -66.91 -67.25 . . 0 "[ . 1 . 2]" 140 . 1 117 GLN C 1 118 MET N 1 118 MET CA 1 118 MET C -95.07 -35.07 -46.92 -55.94 -38.73 . . 0 "[ . 1 . 2]" 141 . 1 118 MET N 1 118 MET CA 1 118 MET C 1 119 GLU N -79.43 0.57 -43.24 -41.07 -43.35 . . 0 "[ . 1 . 2]" 142 . 1 118 MET C 1 119 GLU N 1 119 GLU CA 1 119 GLU C -92.97 -32.97 -59.75 -57.65 -58.52 . . 0 "[ . 1 . 2]" 143 . 1 119 GLU N 1 119 GLU CA 1 119 GLU C 1 120 LEU N -85.49 -5.49 -60.30 -66.38 -51.13 . . 0 "[ . 1 . 2]" 144 . 1 119 GLU C 1 120 LEU N 1 120 LEU CA 1 120 LEU C -93.60 -33.60 -67.63 -76.43 -61.38 . . 0 "[ . 1 . 2]" 145 . 1 120 LEU N 1 120 LEU CA 1 120 LEU C 1 121 VAL N -78.19 1.81 -34.14 -51.78 -24.49 . . 0 "[ . 1 . 2]" 146 . 1 120 LEU C 1 121 VAL N 1 121 VAL CA 1 121 VAL C -96.24 -36.24 -75.14 -73.83 -75.13 . . 0 "[ . 1 . 2]" 147 . 1 121 VAL N 1 121 VAL CA 1 121 VAL C 1 122 MET N -85.25 -5.25 -41.94 -48.13 -33.17 . . 0 "[ . 1 . 2]" 148 . 1 121 VAL C 1 122 MET N 1 122 MET CA 1 122 MET C -90.84 -30.84 -70.18 -76.79 -62.89 . . 0 "[ . 1 . 2]" 149 . 1 122 MET N 1 122 MET CA 1 122 MET C 1 123 LYS N -84.61 -4.61 -34.47 -42.07 -26.48 . . 0 "[ . 1 . 2]" 150 . 1 122 MET C 1 123 LYS N 1 123 LYS CA 1 123 LYS C -93.83 -33.83 -70.45 -78.60 -62.72 . . 0 "[ . 1 . 2]" 151 . 1 123 LYS N 1 123 LYS CA 1 123 LYS C 1 124 ALA N -80.66 -0.66 -29.06 -27.78 -30.43 . . 0 "[ . 1 . 2]" 152 . 1 123 LYS C 1 124 ALA N 1 124 ALA CA 1 124 ALA C -95.60 -35.60 -69.27 -78.54 -59.67 . . 0 "[ . 1 . 2]" 153 . 1 124 ALA N 1 124 ALA CA 1 124 ALA C 1 125 ALA N -63.73 16.27 -38.28 -51.91 -24.62 . . 0 "[ . 1 . 2]" 154 . 1 124 ALA C 1 125 ALA N 1 125 ALA CA 1 125 ALA C -118.44 -58.44 -75.89 -89.03 -63.32 . . 0 "[ . 1 . 2]" 155 . 1 125 ALA N 1 125 ALA CA 1 125 ALA C 1 126 GLY N -38.81 41.19 -19.10 -33.85 1.81 . . 0 "[ . 1 . 2]" 156 . 1 125 ALA C 1 126 GLY N 1 126 GLY CA 1 126 GLY C 53.79 113.79 85.88 81.86 79.22 . . 0 "[ . 1 . 2]" 157 . 1 126 GLY N 1 126 GLY CA 1 126 GLY C 1 127 PHE N -27.01 52.99 35.05 37.04 33.41 . . 0 "[ . 1 . 2]" 158 . 1 127 PHE C 1 128 LYS N 1 128 LYS CA 1 128 LYS C -150.75 -90.75 -104.58 -125.28 -90.63 0.12 10 0 "[ . 1 . 2]" 159 . 1 128 LYS N 1 128 LYS CA 1 128 LYS C 1 129 GLU N 95.30 175.30 125.28 127.39 125.64 0.05 13 0 "[ . 1 . 2]" 160 . 1 128 LYS C 1 129 GLU N 1 129 GLU CA 1 129 GLU C -107.33 -47.33 -78.58 -78.64 -82.15 . . 0 "[ . 1 . 2]" 161 . 1 129 GLU N 1 129 GLU CA 1 129 GLU C 1 130 VAL N 88.78 168.78 133.85 139.22 137.52 . . 0 "[ . 1 . 2]" stop_ save_
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