NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
631924 | 5yio | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_5yio save_dihedral_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 185 _TA_constraint_stats_list.Viol_count 583 _TA_constraint_stats_list.Viol_total 1848.52 _TA_constraint_stats_list.Viol_max 0.97 _TA_constraint_stats_list.Viol_rms 0.08 _TA_constraint_stats_list.Viol_average_all_restraints 0.02 _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 2 ALA C 1 3 GLU N 1 3 GLU CA 1 3 GLU C 173.30 -68.30 -100.42 -116.43 -81.54 . . 0 "[ . 1 . 2]" 2 . 1 3 GLU N 1 3 GLU CA 1 3 GLU C 1 4 LEU N 89.70 -159.30 139.46 135.43 133.30 . . 0 "[ . 1 . 2]" 3 . 1 3 GLU C 1 4 LEU N 1 4 LEU CA 1 4 LEU C -172.70 -91.70 -124.97 -135.29 -112.28 . . 0 "[ . 1 . 2]" 4 . 1 4 LEU N 1 4 LEU CA 1 4 LEU C 1 5 ASN N 110.60 -179.20 118.62 110.47 128.60 0.13 5 0 "[ . 1 . 2]" 5 . 1 4 LEU C 1 5 ASN N 1 5 ASN CA 1 5 ASN C -122.40 -52.00 -58.56 -53.78 -59.31 0.14 8 0 "[ . 1 . 2]" 6 . 1 5 ASN N 1 5 ASN CA 1 5 ASN C 1 6 VAL N 96.70 173.50 134.75 129.29 141.76 . . 0 "[ . 1 . 2]" 7 . 1 5 ASN C 1 6 VAL N 1 6 VAL CA 1 6 VAL C -148.50 -94.50 -139.98 -147.19 -133.39 . . 0 "[ . 1 . 2]" 8 . 1 6 VAL N 1 6 VAL CA 1 6 VAL C 1 7 GLU N 119.60 159.60 154.53 151.13 148.63 . . 0 "[ . 1 . 2]" 9 . 1 6 VAL C 1 7 GLU N 1 7 GLU CA 1 7 GLU C -152.50 -104.70 -151.72 -152.74 -143.52 0.24 17 0 "[ . 1 . 2]" 10 . 1 7 GLU N 1 7 GLU CA 1 7 GLU C 1 8 ILE N 118.20 176.60 140.15 132.19 148.40 . . 0 "[ . 1 . 2]" 11 . 1 7 GLU C 1 8 ILE N 1 8 ILE CA 1 8 ILE C -124.00 -67.80 -120.69 -121.14 -122.33 . . 0 "[ . 1 . 2]" 12 . 1 8 ILE N 1 8 ILE CA 1 8 ILE C 1 9 VAL N 110.10 150.10 113.66 109.98 123.66 0.12 7 0 "[ . 1 . 2]" 13 . 1 8 ILE C 1 9 VAL N 1 9 VAL CA 1 9 VAL C -145.80 -96.80 -98.87 -96.83 -97.02 0.10 6 0 "[ . 1 . 2]" 14 . 1 9 VAL N 1 9 VAL CA 1 9 VAL C 1 10 ALA N 117.90 157.90 136.47 130.15 145.72 . . 0 "[ . 1 . 2]" 15 . 1 9 VAL C 1 10 ALA N 1 10 ALA CA 1 10 ALA C -106.10 -66.10 -99.53 -106.26 -85.44 0.16 17 0 "[ . 1 . 2]" 16 . 1 10 ALA N 1 10 ALA CA 1 10 ALA C 1 11 VAL N 152.40 -160.60 -167.08 -173.30 -161.50 . . 0 "[ . 1 . 2]" 17 . 1 10 ALA C 1 11 VAL N 1 11 VAL CA 1 11 VAL C -83.90 -43.90 -82.77 -84.09 -84.13 0.32 1 0 "[ . 1 . 2]" 18 . 1 11 VAL N 1 11 VAL CA 1 11 VAL C 1 12 ASP N -54.90 -3.90 -37.32 -55.05 -29.54 0.15 6 0 "[ . 1 . 2]" 19 . 1 11 VAL C 1 12 ASP N 1 12 ASP CA 1 12 ASP C -120.20 -71.60 -105.39 -100.52 -108.01 0.27 20 0 "[ . 1 . 2]" 20 . 1 12 ASP N 1 12 ASP CA 1 12 ASP C 1 13 ARG N -25.50 26.50 -18.54 -25.61 -25.64 0.25 9 0 "[ . 1 . 2]" 21 . 1 13 ARG C 1 14 ASN N 1 14 ASN CA 1 14 ASN C -133.20 -32.40 -97.98 -94.27 -100.89 . . 0 "[ . 1 . 2]" 22 . 1 14 ASN N 1 14 ASN CA 1 14 ASN C 1 15 ILE N 88.40 151.20 150.34 141.85 151.36 0.16 14 0 "[ . 1 . 2]" 23 . 1 14 ASN C 1 15 ILE N 1 15 ILE CA 1 15 ILE C -116.40 -37.60 -93.96 -100.03 -83.95 . . 0 "[ . 1 . 2]" 24 . 1 15 ILE N 1 15 ILE CA 1 15 ILE C 1 16 TRP N -76.50 20.50 -68.72 -68.83 -69.04 . . 0 "[ . 1 . 2]" 25 . 1 16 TRP C 1 17 SER N 1 17 SER CA 1 17 SER C -155.00 -64.00 -154.25 -155.15 -143.99 0.15 3 0 "[ . 1 . 2]" 26 . 1 17 SER N 1 17 SER CA 1 17 SER C 1 18 GLY N 83.20 -160.20 116.04 103.51 124.23 . . 0 "[ . 1 . 2]" 27 . 1 18 GLY C 1 19 THR N 1 19 THR CA 1 19 THR C -176.60 -102.40 -130.69 -152.31 -107.82 . . 0 "[ . 1 . 2]" 28 . 1 19 THR N 1 19 THR CA 1 19 THR C 1 20 ALA N 131.80 -179.80 146.86 144.81 143.46 . . 0 "[ . 1 . 2]" 29 . 1 19 THR C 1 20 ALA N 1 20 ALA CA 1 20 ALA C -174.10 -88.90 -147.37 -143.35 -144.03 . . 0 "[ . 1 . 2]" 30 . 1 20 ALA N 1 20 ALA CA 1 20 ALA C 1 21 LYS N 129.00 178.40 161.58 135.29 175.58 . . 0 "[ . 1 . 2]" 31 . 1 21 LYS C 1 22 PHE N 1 22 PHE CA 1 22 PHE C -170.70 -98.50 -169.72 -170.74 -170.80 0.24 7 0 "[ . 1 . 2]" 32 . 1 22 PHE N 1 22 PHE CA 1 22 PHE C 1 23 LEU N 107.20 165.00 165.22 164.14 165.79 0.79 1 0 "[ . 1 . 2]" 33 . 1 22 PHE C 1 23 LEU N 1 23 LEU CA 1 23 LEU C -152.90 -103.10 -147.72 -152.96 -139.96 0.06 8 0 "[ . 1 . 2]" 34 . 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 PHE N 113.70 153.70 153.53 153.73 153.71 0.14 3 0 "[ . 1 . 2]" 35 . 1 23 LEU C 1 24 PHE N 1 24 PHE CA 1 24 PHE C -153.10 -88.50 -122.04 -127.22 -116.54 . . 0 "[ . 1 . 2]" 36 . 1 24 PHE N 1 24 PHE CA 1 24 PHE C 1 25 THR N 102.80 155.80 110.32 109.37 102.97 0.12 11 0 "[ . 1 . 2]" 37 . 1 24 PHE C 1 25 THR N 1 25 THR CA 1 25 THR C -172.20 -54.80 -124.95 -151.86 -111.36 . . 0 "[ . 1 . 2]" 38 . 1 25 THR N 1 25 THR CA 1 25 THR C 1 26 ARG N 83.70 -163.30 165.38 149.56 179.16 . . 0 "[ . 1 . 2]" 39 . 1 25 THR C 1 26 ARG N 1 26 ARG CA 1 26 ARG C -177.40 -70.00 -115.67 -121.07 -123.55 . . 0 "[ . 1 . 2]" 40 . 1 26 ARG N 1 26 ARG CA 1 26 ARG C 1 27 THR N 129.10 169.10 130.71 135.29 132.18 0.13 6 0 "[ . 1 . 2]" 41 . 1 26 ARG C 1 27 THR N 1 27 THR CA 1 27 THR C -140.50 -72.30 -131.07 -140.56 -125.48 0.06 4 0 "[ . 1 . 2]" 42 . 1 27 THR N 1 27 THR CA 1 27 THR C 1 28 THR N 158.80 -161.20 -167.25 -170.13 -164.69 . . 0 "[ . 1 . 2]" 43 . 1 28 THR C 1 29 VAL N 1 29 VAL CA 1 29 VAL C -121.90 -59.70 -83.49 -68.96 -77.22 . . 0 "[ . 1 . 2]" 44 . 1 29 VAL N 1 29 VAL CA 1 29 VAL C 1 30 GLY N -44.30 30.70 -20.50 -18.59 -20.17 . . 0 "[ . 1 . 2]" 45 . 1 29 VAL C 1 30 GLY N 1 30 GLY CA 1 30 GLY C 70.60 115.40 115.53 115.43 115.73 0.33 13 0 "[ . 1 . 2]" 46 . 1 30 GLY C 1 31 GLU N 1 31 GLU CA 1 31 GLU C -107.70 -52.10 -58.24 -59.82 -55.34 . . 0 "[ . 1 . 2]" 47 . 1 31 GLU N 1 31 GLU CA 1 31 GLU C 1 32 ILE N 126.30 166.30 131.56 126.21 144.16 0.09 12 0 "[ . 1 . 2]" 48 . 1 31 GLU C 1 32 ILE N 1 32 ILE CA 1 32 ILE C -157.60 -94.40 -139.76 -132.57 -134.77 . . 0 "[ . 1 . 2]" 49 . 1 32 ILE N 1 32 ILE CA 1 32 ILE C 1 33 GLY N 124.80 173.60 136.98 143.80 140.66 0.03 19 0 "[ . 1 . 2]" 50 . 1 33 GLY C 1 34 ILE N 1 34 ILE CA 1 34 ILE C -137.20 -73.40 -86.08 -84.13 -85.24 . . 0 "[ . 1 . 2]" 51 . 1 34 ILE N 1 34 ILE CA 1 34 ILE C 1 35 LEU N 100.50 147.70 121.20 117.95 115.13 0.08 4 0 "[ . 1 . 2]" 52 . 1 34 ILE C 1 35 LEU N 1 35 LEU CA 1 35 LEU C -153.40 -32.80 -113.34 -145.34 -88.13 . . 0 "[ . 1 . 2]" 53 . 1 35 LEU N 1 35 LEU CA 1 35 LEU C 1 36 PRO N 95.30 174.50 160.22 160.55 159.63 . . 0 "[ . 1 . 2]" 54 . 1 41 LEU C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -174.40 -77.60 -125.87 -148.64 -99.70 . . 0 "[ . 1 . 2]" 55 . 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 ALA N 121.70 171.10 150.57 150.41 149.39 . . 0 "[ . 1 . 2]" 56 . 1 42 VAL C 1 43 ALA N 1 43 ALA CA 1 43 ALA C 176.40 -108.20 -167.53 -162.88 -164.43 . . 0 "[ . 1 . 2]" 57 . 1 43 ALA N 1 43 ALA CA 1 43 ALA C 1 44 GLN N 112.40 163.80 150.68 148.96 145.68 . . 0 "[ . 1 . 2]" 58 . 1 43 ALA C 1 44 GLN N 1 44 GLN CA 1 44 GLN C -117.10 -54.50 -94.02 -106.30 -80.87 . . 0 "[ . 1 . 2]" 59 . 1 44 GLN N 1 44 GLN CA 1 44 GLN C 1 45 LEU N 81.10 172.50 137.22 141.15 140.79 . . 0 "[ . 1 . 2]" 60 . 1 44 GLN C 1 45 LEU N 1 45 LEU CA 1 45 LEU C -107.70 -30.50 -71.33 -82.02 -61.38 . . 0 "[ . 1 . 2]" 61 . 1 45 LEU C 1 46 VAL N 1 46 VAL CA 1 46 VAL C -123.50 -68.10 -121.68 -114.33 -120.44 0.09 6 0 "[ . 1 . 2]" 62 . 1 46 VAL N 1 46 VAL CA 1 46 VAL C 1 47 ASP N -19.50 27.70 26.49 13.07 27.88 0.18 3 0 "[ . 1 . 2]" 63 . 1 46 VAL C 1 47 ASP N 1 47 ASP CA 1 47 ASP C 26.80 85.20 56.58 56.02 55.80 . . 0 "[ . 1 . 2]" 64 . 1 47 ASP N 1 47 ASP CA 1 47 ASP C 1 48 ASP N 10.30 60.30 47.39 25.92 52.94 . . 0 "[ . 1 . 2]" 65 . 1 47 ASP C 1 48 ASP N 1 48 ASP CA 1 48 ASP C -133.10 -77.90 -123.73 -122.46 -124.46 0.07 3 0 "[ . 1 . 2]" 66 . 1 48 ASP N 1 48 ASP CA 1 48 ASP C 1 49 ALA N -12.50 42.10 41.13 33.99 42.19 0.09 14 0 "[ . 1 . 2]" 67 . 1 49 ALA C 1 50 MET N 1 50 MET CA 1 50 MET C -137.30 -83.50 -137.05 -137.35 -137.37 0.10 4 0 "[ . 1 . 2]" 68 . 1 50 MET N 1 50 MET CA 1 50 MET C 1 51 VAL N 97.80 160.40 134.88 124.03 123.90 . . 0 "[ . 1 . 2]" 69 . 1 50 MET C 1 51 VAL N 1 51 VAL CA 1 51 VAL C -139.10 -98.30 -125.06 -139.17 -103.80 0.07 10 0 "[ . 1 . 2]" 70 . 1 51 VAL N 1 51 VAL CA 1 51 VAL C 1 52 ARG N 97.40 145.80 111.98 106.31 118.42 . . 0 "[ . 1 . 2]" 71 . 1 51 VAL C 1 52 ARG N 1 52 ARG CA 1 52 ARG C -134.60 -83.60 -133.68 -129.64 -133.20 0.14 20 0 "[ . 1 . 2]" 72 . 1 52 ARG N 1 52 ARG CA 1 52 ARG C 1 53 VAL N 107.40 147.40 143.82 134.54 147.65 0.25 19 0 "[ . 1 . 2]" 73 . 1 52 ARG C 1 53 VAL N 1 53 VAL CA 1 53 VAL C -142.80 -86.40 -122.01 -118.79 -120.87 . . 0 "[ . 1 . 2]" 74 . 1 53 VAL N 1 53 VAL CA 1 53 VAL C 1 54 GLU N 105.10 145.10 141.35 140.78 137.94 0.37 20 0 "[ . 1 . 2]" 75 . 1 54 GLU C 1 55 ARG N 1 55 ARG CA 1 55 ARG C -158.60 -38.40 -144.79 -149.32 -152.90 0.30 7 0 "[ . 1 . 2]" 76 . 1 55 ARG N 1 55 ARG CA 1 55 ARG C 1 56 GLU N 118.30 166.10 157.49 139.52 164.55 . . 0 "[ . 1 . 2]" 77 . 1 55 ARG C 1 56 GLU N 1 56 GLU CA 1 56 GLU C -80.00 -34.20 -80.12 -80.39 -79.78 0.39 20 0 "[ . 1 . 2]" 78 . 1 56 GLU N 1 56 GLU CA 1 56 GLU C 1 57 GLY N 115.20 155.20 122.12 114.91 114.82 0.75 8 0 "[ . 1 . 2]" 79 . 1 56 GLU C 1 57 GLY N 1 57 GLY CA 1 57 GLY C 60.80 112.60 70.16 60.47 60.41 0.52 8 0 "[ . 1 . 2]" 80 . 1 57 GLY N 1 57 GLY CA 1 57 GLY C 1 58 GLU N -42.50 33.90 21.00 34.21 34.10 0.34 16 0 "[ . 1 . 2]" 81 . 1 57 GLY C 1 58 GLU N 1 58 GLU CA 1 58 GLU C -170.00 -68.40 -148.60 -170.07 -134.24 0.07 20 0 "[ . 1 . 2]" 82 . 1 58 GLU C 1 59 LYS N 1 59 LYS CA 1 59 LYS C -144.00 -27.00 -57.22 -56.46 -57.81 . . 0 "[ . 1 . 2]" 83 . 1 59 LYS N 1 59 LYS CA 1 59 LYS C 1 60 ASP N 108.40 169.80 154.92 135.45 169.88 0.08 10 0 "[ . 1 . 2]" 84 . 1 60 ASP C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -160.30 -56.70 -80.17 -122.68 -62.02 . . 0 "[ . 1 . 2]" 85 . 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 ARG N 100.70 176.10 106.73 111.33 108.75 0.09 14 0 "[ . 1 . 2]" 86 . 1 61 LEU C 1 62 ARG N 1 62 ARG CA 1 62 ARG C -162.50 -60.50 -82.69 -88.26 -77.17 . . 0 "[ . 1 . 2]" 87 . 1 62 ARG N 1 62 ARG CA 1 62 ARG C 1 63 ILE N 104.00 174.00 107.45 105.51 103.96 0.19 10 0 "[ . 1 . 2]" 88 . 1 62 ARG C 1 63 ILE N 1 63 ILE CA 1 63 ILE C -159.50 -106.50 -122.90 -130.70 -114.35 . . 0 "[ . 1 . 2]" 89 . 1 63 ILE N 1 63 ILE CA 1 63 ILE C 1 64 ALA N 109.00 164.40 155.21 152.00 150.41 . . 0 "[ . 1 . 2]" 90 . 1 63 ILE C 1 64 ALA N 1 64 ALA CA 1 64 ALA C -157.60 -71.60 -133.21 -131.12 -131.74 . . 0 "[ . 1 . 2]" 91 . 1 64 ALA N 1 64 ALA CA 1 64 ALA C 1 65 VAL N 89.50 157.50 91.98 89.42 97.33 0.08 8 0 "[ . 1 . 2]" 92 . 1 64 ALA C 1 65 VAL N 1 65 VAL CA 1 65 VAL C -168.40 -65.60 -94.76 -89.25 -91.57 . . 0 "[ . 1 . 2]" 93 . 1 65 VAL N 1 65 VAL CA 1 65 VAL C 1 66 ASP N 95.00 174.00 157.34 145.62 169.34 . . 0 "[ . 1 . 2]" 94 . 1 65 VAL C 1 66 ASP N 1 66 ASP CA 1 66 ASP C -165.50 -68.50 -133.90 -130.79 -132.19 . . 0 "[ . 1 . 2]" 95 . 1 66 ASP N 1 66 ASP CA 1 66 ASP C 1 67 GLY N 95.10 149.70 109.06 95.07 123.22 0.03 17 0 "[ . 1 . 2]" 96 . 1 66 ASP C 1 67 GLY N 1 67 GLY CA 1 67 GLY C 25.30 94.30 51.53 53.23 53.10 . . 0 "[ . 1 . 2]" 97 . 1 67 GLY N 1 67 GLY CA 1 67 GLY C 1 68 GLY N -17.30 83.10 79.08 59.91 83.36 0.26 1 0 "[ . 1 . 2]" 98 . 1 68 GLY C 1 69 PHE N 1 69 PHE CA 1 69 PHE C -170.30 -101.70 -111.76 -121.82 -102.80 . . 0 "[ . 1 . 2]" 99 . 1 69 PHE N 1 69 PHE CA 1 69 PHE C 1 70 LEU N 113.60 153.60 120.51 113.61 152.28 . . 0 "[ . 1 . 2]" 100 . 1 69 PHE C 1 70 LEU N 1 70 LEU CA 1 70 LEU C -164.60 -81.00 -98.19 -96.63 -98.39 . . 0 "[ . 1 . 2]" 101 . 1 70 LEU N 1 70 LEU CA 1 70 LEU C 1 71 SER N 111.40 160.80 123.62 122.61 122.51 . . 0 "[ . 1 . 2]" 102 . 1 70 LEU C 1 71 SER N 1 71 SER CA 1 71 SER C -136.50 -87.50 -126.00 -123.80 -125.08 0.09 13 0 "[ . 1 . 2]" 103 . 1 71 SER N 1 71 SER CA 1 71 SER C 1 72 VAL N 100.60 147.00 101.62 101.11 100.64 0.29 1 0 "[ . 1 . 2]" 104 . 1 71 SER C 1 72 VAL N 1 72 VAL CA 1 72 VAL C -131.00 -83.20 -82.90 -83.32 -82.72 0.48 1 0 "[ . 1 . 2]" 105 . 1 72 VAL N 1 72 VAL CA 1 72 VAL C 1 73 THR N 111.40 151.40 116.75 111.33 122.93 0.07 8 0 "[ . 1 . 2]" 106 . 1 72 VAL C 1 73 THR N 1 73 THR CA 1 73 THR C -148.60 -53.60 -141.45 -139.41 -141.59 . . 0 "[ . 1 . 2]" 107 . 1 73 THR N 1 73 THR CA 1 73 THR C 1 74 GLU N 147.80 -172.20 147.30 147.13 147.00 0.97 1 0 "[ . 1 . 2]" 108 . 1 73 THR C 1 74 GLU N 1 74 GLU CA 1 74 GLU C -81.60 -41.60 -66.23 -65.79 -66.15 . . 0 "[ . 1 . 2]" 109 . 1 74 GLU N 1 74 GLU CA 1 74 GLU C 1 75 GLU N -53.60 -7.00 -29.09 -30.70 -27.63 . . 0 "[ . 1 . 2]" 110 . 1 74 GLU C 1 75 GLU N 1 75 GLU CA 1 75 GLU C -107.60 -67.60 -67.33 -67.50 -66.91 0.69 1 0 "[ . 1 . 2]" 111 . 1 75 GLU N 1 75 GLU CA 1 75 GLU C 1 76 GLY N -34.60 19.00 -21.25 -20.51 -21.21 . . 0 "[ . 1 . 2]" 112 . 1 77 VAL C 1 78 SER N 1 78 SER CA 1 78 SER C -132.60 -92.60 -131.44 -132.80 -124.71 0.20 7 0 "[ . 1 . 2]" 113 . 1 78 SER N 1 78 SER CA 1 78 SER C 1 79 ILE N 106.90 149.50 130.29 126.72 133.85 . . 0 "[ . 1 . 2]" 114 . 1 78 SER C 1 79 ILE N 1 79 ILE CA 1 79 ILE C -128.60 -88.60 -127.67 -126.71 -128.62 0.26 11 0 "[ . 1 . 2]" 115 . 1 79 ILE N 1 79 ILE CA 1 79 ILE C 1 80 LEU N 101.50 141.50 104.16 103.94 103.27 0.16 13 0 "[ . 1 . 2]" 116 . 1 79 ILE C 1 80 LEU N 1 80 LEU CA 1 80 LEU C -138.40 -76.00 -92.21 -96.86 -89.20 . . 0 "[ . 1 . 2]" 117 . 1 80 LEU N 1 80 LEU CA 1 80 LEU C 1 81 ALA N 96.20 160.20 97.35 99.88 98.34 0.19 1 0 "[ . 1 . 2]" 118 . 1 80 LEU C 1 81 ALA N 1 81 ALA CA 1 81 ALA C -124.40 -58.00 -96.61 -99.88 -93.20 . . 0 "[ . 1 . 2]" 119 . 1 81 ALA N 1 81 ALA CA 1 81 ALA C 1 82 GLU N 130.20 -177.60 154.24 154.69 153.80 . . 0 "[ . 1 . 2]" 120 . 1 81 ALA C 1 82 GLU N 1 82 GLU CA 1 82 GLU C -92.70 -52.70 -83.80 -81.00 -82.35 . . 0 "[ . 1 . 2]" 121 . 1 82 GLU N 1 82 GLU CA 1 82 GLU C 1 83 SER N -56.50 12.50 -24.35 -29.60 -17.77 . . 0 "[ . 1 . 2]" 122 . 1 83 SER C 1 84 ALA N 1 84 ALA CA 1 84 ALA C -177.00 -81.40 -86.76 -84.03 -84.66 0.11 17 0 "[ . 1 . 2]" 123 . 1 84 ALA N 1 84 ALA CA 1 84 ALA C 1 85 GLU N 113.80 -179.00 159.41 170.92 166.67 . . 0 "[ . 1 . 2]" 124 . 1 84 ALA C 1 85 GLU N 1 85 GLU CA 1 85 GLU C -176.80 -117.40 -147.11 -153.76 -154.49 . . 0 "[ . 1 . 2]" 125 . 1 85 GLU N 1 85 GLU CA 1 85 GLU C 1 86 PHE N 121.60 169.00 139.27 121.51 162.64 0.09 16 0 "[ . 1 . 2]" 126 . 1 85 GLU C 1 86 PHE N 1 86 PHE CA 1 86 PHE C -167.10 -30.30 -74.73 -94.06 -58.55 . . 0 "[ . 1 . 2]" 127 . 1 86 PHE N 1 86 PHE CA 1 86 PHE C 1 87 GLU N 98.10 166.50 165.93 160.01 166.65 0.15 3 0 "[ . 1 . 2]" 128 . 1 86 PHE C 1 87 GLU N 1 87 GLU CA 1 87 GLU C -78.30 -38.30 -55.44 -55.52 -56.15 . . 0 "[ . 1 . 2]" 129 . 1 87 GLU N 1 87 GLU CA 1 87 GLU C 1 88 SER N -63.50 -6.30 -27.21 -41.18 -15.50 . . 0 "[ . 1 . 2]" 130 . 1 87 GLU C 1 88 SER N 1 88 SER CA 1 88 SER C -94.90 -45.10 -69.46 -91.47 -56.11 . . 0 "[ . 1 . 2]" 131 . 1 88 SER N 1 88 SER CA 1 88 SER C 1 89 GLU N -46.70 18.50 -14.38 -22.88 -24.18 . . 0 "[ . 1 . 2]" 132 . 1 88 SER C 1 89 GLU N 1 89 GLU CA 1 89 GLU C -123.50 -69.30 -100.09 -96.30 -96.65 0.09 13 0 "[ . 1 . 2]" 133 . 1 89 GLU N 1 89 GLU CA 1 89 GLU C 1 90 ILE N -58.20 33.60 33.10 27.81 34.00 0.40 6 0 "[ . 1 . 2]" 134 . 1 90 ILE C 1 91 ASP N 1 91 ASP CA 1 91 ASP C -119.20 -65.80 -66.99 -65.75 -65.76 0.28 19 0 "[ . 1 . 2]" 135 . 1 91 ASP N 1 91 ASP CA 1 91 ASP C 1 92 GLU N 71.40 152.40 152.66 152.47 152.95 0.55 17 0 "[ . 1 . 2]" 136 . 1 91 ASP C 1 92 GLU N 1 92 GLU CA 1 92 GLU C -77.10 -37.10 -46.50 -56.44 -38.02 . . 0 "[ . 1 . 2]" 137 . 1 92 GLU N 1 92 GLU CA 1 92 GLU C 1 93 ALA N -61.30 -19.30 -32.01 -28.29 -28.83 . . 0 "[ . 1 . 2]" 138 . 1 92 GLU C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -81.40 -41.40 -58.32 -55.34 -55.34 . . 0 "[ . 1 . 2]" 139 . 1 93 ALA N 1 93 ALA CA 1 93 ALA C 1 94 ALA N -61.20 -21.20 -51.48 -55.19 -56.47 . . 0 "[ . 1 . 2]" 140 . 1 93 ALA C 1 94 ALA N 1 94 ALA CA 1 94 ALA C -88.50 -48.50 -70.98 -76.36 -64.18 . . 0 "[ . 1 . 2]" 141 . 1 94 ALA N 1 94 ALA CA 1 94 ALA C 1 95 ALA N -61.10 -21.10 -34.53 -34.00 -35.62 . . 0 "[ . 1 . 2]" 142 . 1 94 ALA C 1 95 ALA N 1 95 ALA CA 1 95 ALA C -86.30 -46.30 -63.28 -70.20 -54.42 . . 0 "[ . 1 . 2]" 143 . 1 95 ALA N 1 95 ALA CA 1 95 ALA C 1 96 LYS N -61.80 -21.80 -32.46 -24.38 -25.31 . . 0 "[ . 1 . 2]" 144 . 1 95 ALA C 1 96 LYS N 1 96 LYS CA 1 96 LYS C -85.00 -45.00 -76.15 -85.06 -57.61 0.06 6 0 "[ . 1 . 2]" 145 . 1 96 LYS N 1 96 LYS CA 1 96 LYS C 1 97 GLN N -62.70 -22.70 -49.68 -57.90 -35.84 . . 0 "[ . 1 . 2]" 146 . 1 96 LYS C 1 97 GLN N 1 97 GLN CA 1 97 GLN C -82.70 -42.70 -55.66 -60.32 -50.36 . . 0 "[ . 1 . 2]" 147 . 1 97 GLN N 1 97 GLN CA 1 97 GLN C 1 98 ASP N -62.60 -22.60 -45.66 -62.62 -31.83 0.02 11 0 "[ . 1 . 2]" 148 . 1 97 GLN C 1 98 ASP N 1 98 ASP CA 1 98 ASP C -83.70 -43.70 -73.85 -69.43 -70.16 0.58 4 0 "[ . 1 . 2]" 149 . 1 98 ASP N 1 98 ASP CA 1 98 ASP C 1 99 SER N -62.30 -22.30 -32.52 -35.37 -35.59 . . 0 "[ . 1 . 2]" 150 . 1 98 ASP C 1 99 SER N 1 99 SER CA 1 99 SER C -83.30 -43.30 -57.90 -60.90 -54.91 . . 0 "[ . 1 . 2]" 151 . 1 99 SER N 1 99 SER CA 1 99 SER C 1 100 GLU N -62.00 -10.80 -31.26 -31.43 -31.73 . . 0 "[ . 1 . 2]" 152 . 1 99 SER C 1 100 GLU N 1 100 GLU CA 1 100 GLU C -108.60 -36.00 -57.49 -72.96 -49.47 . . 0 "[ . 1 . 2]" 153 . 1 100 GLU N 1 100 GLU CA 1 100 GLU C 1 101 SER N -67.00 1.20 -21.33 -19.21 -21.44 . . 0 "[ . 1 . 2]" 154 . 1 102 ASP C 1 103 ASP N 1 103 ASP CA 1 103 ASP C -159.60 -38.80 -156.34 -156.53 -159.62 0.42 1 0 "[ . 1 . 2]" 155 . 1 103 ASP N 1 103 ASP CA 1 103 ASP C 1 104 PRO N 94.30 179.90 161.45 164.30 163.51 . . 0 "[ . 1 . 2]" 156 . 1 104 PRO C 1 105 ARG N 1 105 ARG CA 1 105 ARG C -86.70 -46.70 -71.81 -71.40 -74.19 . . 0 "[ . 1 . 2]" 157 . 1 105 ARG N 1 105 ARG CA 1 105 ARG C 1 106 ILE N -52.50 -12.50 -38.92 -34.84 -39.17 . . 0 "[ . 1 . 2]" 158 . 1 105 ARG C 1 106 ILE N 1 106 ILE CA 1 106 ILE C -85.30 -45.30 -65.88 -76.51 -59.83 . . 0 "[ . 1 . 2]" 159 . 1 106 ILE N 1 106 ILE CA 1 106 ILE C 1 107 ALA N -58.00 -18.00 -34.40 -41.32 -28.10 . . 0 "[ . 1 . 2]" 160 . 1 106 ILE C 1 107 ALA N 1 107 ALA CA 1 107 ALA C -81.50 -41.50 -68.78 -65.02 -67.20 . . 0 "[ . 1 . 2]" 161 . 1 107 ALA N 1 107 ALA CA 1 107 ALA C 1 108 ALA N -62.50 -16.50 -54.36 -59.04 -46.61 . . 0 "[ . 1 . 2]" 162 . 1 107 ALA C 1 108 ALA N 1 108 ALA CA 1 108 ALA C -84.30 -44.30 -60.04 -59.23 -59.70 . . 0 "[ . 1 . 2]" 163 . 1 108 ALA N 1 108 ALA CA 1 108 ALA C 1 109 ARG N -59.20 -19.20 -44.62 -41.00 -43.05 . . 0 "[ . 1 . 2]" 164 . 1 108 ALA C 1 109 ARG N 1 109 ARG CA 1 109 ARG C -85.20 -45.20 -71.73 -77.27 -67.38 . . 0 "[ . 1 . 2]" 165 . 1 109 ARG N 1 109 ARG CA 1 109 ARG C 1 110 GLY N -61.90 -21.90 -33.30 -32.37 -32.41 . . 0 "[ . 1 . 2]" 166 . 1 109 ARG C 1 110 GLY N 1 110 GLY CA 1 110 GLY C -83.70 -43.70 -58.68 -63.76 -57.04 . . 0 "[ . 1 . 2]" 167 . 1 110 GLY N 1 110 GLY CA 1 110 GLY C 1 111 ARG N -64.90 -24.90 -48.31 -46.41 -48.81 . . 0 "[ . 1 . 2]" 168 . 1 110 GLY C 1 111 ARG N 1 111 ARG CA 1 111 ARG C -81.30 -41.30 -66.76 -75.67 -61.14 . . 0 "[ . 1 . 2]" 169 . 1 111 ARG N 1 111 ARG CA 1 111 ARG C 1 112 ALA N -65.50 -25.50 -40.62 -50.23 -36.24 . . 0 "[ . 1 . 2]" 170 . 1 111 ARG C 1 112 ALA N 1 112 ALA CA 1 112 ALA C -81.30 -41.30 -63.09 -62.75 -63.85 . . 0 "[ . 1 . 2]" 171 . 1 112 ALA N 1 112 ALA CA 1 112 ALA C 1 113 ARG N -65.10 -25.10 -41.08 -36.67 -36.72 . . 0 "[ . 1 . 2]" 172 . 1 112 ALA C 1 113 ARG N 1 113 ARG CA 1 113 ARG C -78.10 -38.10 -64.17 -66.69 -70.10 . . 0 "[ . 1 . 2]" 173 . 1 113 ARG N 1 113 ARG CA 1 113 ARG C 1 114 LEU N -68.10 -19.90 -51.09 -58.34 -42.68 . . 0 "[ . 1 . 2]" 174 . 1 113 ARG C 1 114 LEU N 1 114 LEU CA 1 114 LEU C -93.00 -48.00 -55.11 -60.13 -48.17 . . 0 "[ . 1 . 2]" 175 . 1 114 LEU N 1 114 LEU CA 1 114 LEU C 1 115 ARG N -59.40 -19.40 -44.40 -37.97 -41.55 . . 0 "[ . 1 . 2]" 176 . 1 114 LEU C 1 115 ARG N 1 115 ARG CA 1 115 ARG C -80.80 -40.80 -57.77 -62.94 -52.68 . . 0 "[ . 1 . 2]" 177 . 1 115 ARG N 1 115 ARG CA 1 115 ARG C 1 116 ALA N -65.60 -25.60 -40.89 -47.67 -49.30 . . 0 "[ . 1 . 2]" 178 . 1 115 ARG C 1 116 ALA N 1 116 ALA CA 1 116 ALA C -86.70 -46.70 -75.89 -86.70 -61.14 0.00 14 0 "[ . 1 . 2]" 179 . 1 116 ALA N 1 116 ALA CA 1 116 ALA C 1 117 VAL N -47.40 -7.40 -27.96 -29.92 -30.95 . . 0 "[ . 1 . 2]" 180 . 1 116 ALA C 1 117 VAL N 1 117 VAL CA 1 117 VAL C -116.70 -76.70 -76.64 -76.64 -76.66 0.19 4 0 "[ . 1 . 2]" 181 . 1 117 VAL N 1 117 VAL CA 1 117 VAL C 1 118 GLY N -13.20 26.80 -10.80 -10.54 -11.96 0.19 10 0 "[ . 1 . 2]" 182 . 1 117 VAL C 1 118 GLY N 1 118 GLY CA 1 118 GLY C 27.40 102.00 95.18 101.49 100.29 0.09 3 0 "[ . 1 . 2]" 183 . 1 118 GLY N 1 118 GLY CA 1 118 GLY C 1 119 ALA N -3.70 58.50 29.24 26.73 36.07 . . 0 "[ . 1 . 2]" 184 . 1 118 GLY C 1 119 ALA N 1 119 ALA CA 1 119 ALA C -106.60 -48.40 -86.94 -106.60 -69.43 . . 0 "[ . 1 . 2]" 185 . 1 119 ALA N 1 119 ALA CA 1 119 ALA C 1 120 ILE N -65.40 15.60 -23.86 -34.00 -48.03 0.21 11 0 "[ . 1 . 2]" stop_ save_
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