NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
428403 | 2i7k | 7287 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2i7k save_distance_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 115 _TA_constraint_stats_list.Viol_count 608 _TA_constraint_stats_list.Viol_total 4843.75 _TA_constraint_stats_list.Viol_max 2.29 _TA_constraint_stats_list.Viol_rms 0.24 _TA_constraint_stats_list.Viol_average_all_restraints 0.11 _TA_constraint_stats_list.Viol_average_violations_only 0.40 _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 7 THR C 1 8 PRO N 1 8 PRO CA 1 8 PRO C -63.43 -51.09 -52.49 -57.64 -50.61 0.48 20 0 "[ . 1 . 2]" 2 . 1 8 PRO N 1 8 PRO CA 1 8 PRO C 1 9 LEU N -45.53 -23.43 -39.27 -43.92 -31.82 . . 0 "[ . 1 . 2]" 3 . 1 8 PRO C 1 9 LEU N 1 9 LEU CA 1 9 LEU C -74.11 -57.29 -60.46 -69.59 -56.78 0.51 14 0 "[ . 1 . 2]" 4 . 1 9 LEU N 1 9 LEU CA 1 9 LEU C 1 10 GLN N -43.96 -34.64 -40.64 -38.35 -39.82 0.46 5 0 "[ . 1 . 2]" 5 . 1 9 LEU C 1 10 GLN N 1 10 GLN CA 1 10 GLN C -65.86 -56.50 -61.40 -66.24 -56.43 0.38 5 0 "[ . 1 . 2]" 6 . 1 10 GLN N 1 10 GLN CA 1 10 GLN C 1 11 GLU N -43.23 -34.89 -39.72 -43.31 -34.82 0.08 10 0 "[ . 1 . 2]" 7 . 1 10 GLN C 1 11 GLU N 1 11 GLU CA 1 11 GLU C -66.43 -60.71 -61.77 -60.70 -61.01 0.51 18 0 "[ . 1 . 2]" 8 . 1 11 GLU N 1 11 GLU CA 1 11 GLU C 1 12 ALA N -46.57 -40.53 -46.01 -43.53 -45.41 0.25 7 0 "[ . 1 . 2]" 9 . 1 11 GLU C 1 12 ALA N 1 12 ALA CA 1 12 ALA C -69.51 -58.31 -62.32 -60.94 -61.23 . . 0 "[ . 1 . 2]" 10 . 1 12 ALA N 1 12 ALA CA 1 12 ALA C 1 13 LEU N -47.46 -34.84 -42.32 -46.51 -47.01 0.28 20 0 "[ . 1 . 2]" 11 . 1 12 ALA C 1 13 LEU N 1 13 LEU CA 1 13 LEU C -72.56 -55.88 -61.29 -56.36 -57.93 . . 0 "[ . 1 . 2]" 12 . 1 13 LEU N 1 13 LEU CA 1 13 LEU C 1 14 ASN N -45.14 -34.78 -44.13 -46.41 -38.51 1.27 8 0 "[ . 1 . 2]" 13 . 1 13 LEU C 1 14 ASN N 1 14 ASN CA 1 14 ASN C -67.23 -59.13 -63.59 -67.97 -59.20 0.74 8 0 "[ . 1 . 2]" 14 . 1 14 ASN N 1 14 ASN CA 1 14 ASN C 1 15 GLN N -45.53 -33.87 -36.72 -41.61 -32.61 1.26 11 0 "[ . 1 . 2]" 15 . 1 14 ASN C 1 15 GLN N 1 15 GLN CA 1 15 GLN C -71.28 -65.14 -65.32 -64.70 -64.77 0.75 11 0 "[ . 1 . 2]" 16 . 1 15 GLN N 1 15 GLN CA 1 15 GLN C 1 16 LEU N -46.71 -36.17 -44.33 -36.27 -38.67 0.40 11 0 "[ . 1 . 2]" 17 . 1 15 GLN C 1 16 LEU N 1 16 LEU CA 1 16 LEU C -71.10 -55.04 -63.29 -71.26 -55.07 0.16 5 0 "[ . 1 . 2]" 18 . 1 16 LEU N 1 16 LEU CA 1 16 LEU C 1 17 MET N -45.92 -27.64 -41.43 -43.11 -44.36 0.35 13 0 "[ . 1 . 2]" 19 . 1 16 LEU C 1 17 MET N 1 17 MET CA 1 17 MET C -68.19 -57.93 -64.21 -63.60 -64.22 . . 0 "[ . 1 . 2]" 20 . 1 17 MET N 1 17 MET CA 1 17 MET C 1 18 ARG N -46.57 -31.51 -42.88 -46.79 -34.36 0.22 9 0 "[ . 1 . 2]" 21 . 1 17 MET C 1 18 ARG N 1 18 ARG CA 1 18 ARG C -70.41 -58.23 -63.68 -67.82 -59.21 . . 0 "[ . 1 . 2]" 22 . 1 18 ARG N 1 18 ARG CA 1 18 ARG C 1 19 GLN N -45.82 -36.96 -41.62 -41.43 -43.24 0.52 2 0 "[ . 1 . 2]" 23 . 1 18 ARG C 1 19 GLN N 1 19 GLN CA 1 19 GLN C -69.18 -59.74 -64.00 -66.60 -68.21 0.14 7 0 "[ . 1 . 2]" 24 . 1 19 GLN N 1 19 GLN CA 1 19 GLN C 1 20 LEU N -48.79 -36.33 -43.73 -49.08 -38.56 0.29 2 0 "[ . 1 . 2]" 25 . 1 19 GLN C 1 20 LEU N 1 20 LEU CA 1 20 LEU C -70.60 -58.66 -65.81 -70.76 -58.92 0.16 13 0 "[ . 1 . 2]" 26 . 1 20 LEU N 1 20 LEU CA 1 20 LEU C 1 21 GLN N -45.64 -32.16 -40.65 -40.73 -41.11 0.58 19 0 "[ . 1 . 2]" 27 . 1 20 LEU C 1 21 GLN N 1 21 GLN CA 1 21 GLN C -67.79 -58.91 -66.01 -68.37 -60.19 0.58 4 0 "[ . 1 . 2]" 28 . 1 21 GLN N 1 21 GLN CA 1 21 GLN C 1 22 ARG N -46.54 -37.08 -38.63 -43.73 -36.20 0.88 11 0 "[ . 1 . 2]" 29 . 1 21 GLN C 1 22 ARG N 1 22 ARG CA 1 22 ARG C -75.39 -61.15 -69.03 -75.27 -62.78 . . 0 "[ . 1 . 2]" 30 . 1 22 ARG N 1 22 ARG CA 1 22 ARG C 1 23 LYS N -37.76 -16.94 -16.70 -16.71 -16.79 0.62 17 0 "[ . 1 . 2]" 31 . 1 40 GLY C 1 41 TYR N 1 41 TYR CA 1 41 TYR C -66.71 -53.47 -56.97 -53.82 -54.25 0.55 12 0 "[ . 1 . 2]" 32 . 1 41 TYR N 1 41 TYR CA 1 41 TYR C 1 42 SER N -52.12 -31.00 -47.57 -52.95 -35.39 0.83 16 0 "[ . 1 . 2]" 33 . 1 41 TYR C 1 42 SER N 1 42 SER CA 1 42 SER C -65.59 -58.35 -63.12 -67.01 -58.42 1.42 12 0 "[ . 1 . 2]" 34 . 1 42 SER N 1 42 SER CA 1 42 SER C 1 43 MET N -40.63 -25.85 -26.61 -34.19 -25.02 0.83 18 0 "[ . 1 . 2]" 35 . 1 42 SER C 1 43 MET N 1 43 MET CA 1 43 MET C -89.68 -65.96 -78.23 -80.32 -83.64 . . 0 "[ . 1 . 2]" 36 . 1 43 MET N 1 43 MET CA 1 43 MET C 1 44 ILE N -49.62 -14.86 -36.39 -28.37 -33.72 0.26 18 0 "[ . 1 . 2]" 37 . 1 50 ASP C 1 51 PHE N 1 51 PHE CA 1 51 PHE C -62.66 -52.88 -59.86 -61.48 -62.26 0.46 13 0 "[ . 1 . 2]" 38 . 1 51 PHE N 1 51 PHE CA 1 51 PHE C 1 52 SER N -44.47 -29.81 -33.67 -40.16 -29.76 0.05 19 0 "[ . 1 . 2]" 39 . 1 51 PHE C 1 52 SER N 1 52 SER CA 1 52 SER C -72.50 -62.32 -71.14 -73.22 -63.62 0.72 8 0 "[ . 1 . 2]" 40 . 1 52 SER N 1 52 SER CA 1 52 SER C 1 53 THR N -41.26 -28.22 -41.50 -42.95 -37.60 1.69 14 0 "[ . 1 . 2]" 41 . 1 52 SER C 1 53 THR N 1 53 THR CA 1 53 THR C -71.85 -60.65 -65.91 -64.43 -65.42 0.44 12 0 "[ . 1 . 2]" 42 . 1 53 THR N 1 53 THR CA 1 53 THR C 1 54 MET N -50.92 -33.04 -47.24 -51.19 -39.18 0.27 14 0 "[ . 1 . 2]" 43 . 1 53 THR C 1 54 MET N 1 54 MET CA 1 54 MET C -68.55 -55.39 -65.48 -69.01 -61.35 0.46 5 0 "[ . 1 . 2]" 44 . 1 54 MET N 1 54 MET CA 1 54 MET C 1 55 LYS N -48.98 -41.80 -42.69 -44.16 -45.31 0.81 11 0 "[ . 1 . 2]" 45 . 1 54 MET C 1 55 LYS N 1 55 LYS CA 1 55 LYS C -71.95 -59.37 -59.21 -61.76 -58.51 0.86 4 0 "[ . 1 . 2]" 46 . 1 55 LYS N 1 55 LYS CA 1 55 LYS C 1 56 GLU N -44.13 -34.21 -43.06 -39.15 -39.70 0.66 15 0 "[ . 1 . 2]" 47 . 1 55 LYS C 1 56 GLU N 1 56 GLU CA 1 56 GLU C -71.57 -63.09 -63.39 -65.70 -62.21 0.88 8 0 "[ . 1 . 2]" 48 . 1 56 GLU N 1 56 GLU CA 1 56 GLU C 1 57 LYS N -46.92 -35.18 -38.14 -42.38 -36.10 . . 0 "[ . 1 . 2]" 49 . 1 56 GLU C 1 57 LYS N 1 57 LYS CA 1 57 LYS C -68.38 -60.88 -67.48 -68.76 -64.97 0.38 14 0 "[ . 1 . 2]" 50 . 1 57 LYS N 1 57 LYS CA 1 57 LYS C 1 58 ILE N -46.02 -35.50 -41.02 -43.86 -35.80 . . 0 "[ . 1 . 2]" 51 . 1 57 LYS C 1 58 ILE N 1 58 ILE CA 1 58 ILE C -70.39 -59.65 -59.03 -59.35 -59.55 1.25 18 0 "[ . 1 . 2]" 52 . 1 58 ILE N 1 58 ILE CA 1 58 ILE C 1 59 LYS N -50.39 -40.75 -40.38 -40.65 -41.31 1.09 6 0 "[ . 1 . 2]" 53 . 1 58 ILE C 1 59 LYS N 1 59 LYS CA 1 59 LYS C -68.56 -59.80 -59.57 -60.10 -60.20 0.89 9 0 "[ . 1 . 2]" 54 . 1 59 LYS N 1 59 LYS CA 1 59 LYS C 1 60 ASN N -37.83 -19.69 -24.19 -27.88 -20.55 . . 0 "[ . 1 . 2]" 55 . 1 65 SER C 1 66 ILE N 1 66 ILE CA 1 66 ILE C -65.59 -54.21 -54.00 -55.29 -56.15 1.15 13 0 "[ . 1 . 2]" 56 . 1 66 ILE N 1 66 ILE CA 1 66 ILE C 1 67 GLU N -46.88 -28.98 -38.83 -35.40 -35.91 . . 0 "[ . 1 . 2]" 57 . 1 66 ILE C 1 67 GLU N 1 67 GLU CA 1 67 GLU C -69.43 -55.01 -69.78 -69.63 -69.64 0.97 19 0 "[ . 1 . 2]" 58 . 1 67 GLU N 1 67 GLU CA 1 67 GLU C 1 68 GLU N -45.00 -32.96 -40.47 -44.19 -38.08 . . 0 "[ . 1 . 2]" 59 . 1 67 GLU C 1 68 GLU N 1 68 GLU CA 1 68 GLU C -69.13 -63.49 -67.79 -69.62 -63.23 0.49 2 0 "[ . 1 . 2]" 60 . 1 68 GLU N 1 68 GLU CA 1 68 GLU C 1 69 LEU N -47.46 -38.72 -47.86 -47.69 -47.79 0.94 8 0 "[ . 1 . 2]" 61 . 1 68 GLU C 1 69 LEU N 1 69 LEU CA 1 69 LEU C -72.05 -57.61 -65.01 -58.13 -60.63 0.20 2 0 "[ . 1 . 2]" 62 . 1 69 LEU N 1 69 LEU CA 1 69 LEU C 1 70 LYS N -51.61 -29.91 -41.71 -43.85 -44.85 . . 0 "[ . 1 . 2]" 63 . 1 69 LEU C 1 70 LYS N 1 70 LYS CA 1 70 LYS C -71.88 -58.72 -66.52 -72.00 -60.05 0.12 16 0 "[ . 1 . 2]" 64 . 1 70 LYS N 1 70 LYS CA 1 70 LYS C 1 71 ASP N -46.22 -37.14 -42.04 -39.51 -40.53 0.45 10 0 "[ . 1 . 2]" 65 . 1 70 LYS C 1 71 ASP N 1 71 ASP CA 1 71 ASP C -73.07 -57.93 -59.78 -62.33 -57.72 0.21 6 0 "[ . 1 . 2]" 66 . 1 71 ASP N 1 71 ASP CA 1 71 ASP C 1 72 ASN N -45.84 -26.12 -44.86 -45.04 -45.71 0.78 15 0 "[ . 1 . 2]" 67 . 1 71 ASP C 1 72 ASN N 1 72 ASN CA 1 72 ASN C -74.62 -62.52 -69.40 -72.20 -73.05 0.38 1 0 "[ . 1 . 2]" 68 . 1 72 ASN N 1 72 ASN CA 1 72 ASN C 1 73 PHE N -48.60 -32.10 -48.41 -49.57 -44.78 0.97 17 0 "[ . 1 . 2]" 69 . 1 72 ASN C 1 73 PHE N 1 73 PHE CA 1 73 PHE C -68.78 -59.14 -61.42 -65.22 -59.01 0.13 15 0 "[ . 1 . 2]" 70 . 1 73 PHE N 1 73 PHE CA 1 73 PHE C 1 74 LYS N -50.22 -36.86 -45.95 -49.77 -37.30 . . 0 "[ . 1 . 2]" 71 . 1 73 PHE C 1 74 LYS N 1 74 LYS CA 1 74 LYS C -67.08 -56.60 -64.76 -67.56 -61.12 0.48 18 0 "[ . 1 . 2]" 72 . 1 74 LYS N 1 74 LYS CA 1 74 LYS C 1 75 LEU N -48.69 -36.07 -36.32 -48.60 -35.13 0.94 8 0 "[ . 1 . 2]" 73 . 1 74 LYS C 1 75 LEU N 1 75 LEU CA 1 75 LEU C -71.96 -60.54 -60.29 -59.89 -59.92 0.67 2 0 "[ . 1 . 2]" 74 . 1 75 LEU N 1 75 LEU CA 1 75 LEU C 1 76 MET N -44.59 -38.97 -45.70 -45.11 -45.26 2.29 15 0 "[ . 1 . 2]" 75 . 1 75 LEU C 1 76 MET N 1 76 MET CA 1 76 MET C -66.11 -59.15 -66.26 -66.04 -66.19 1.46 14 0 "[ . 1 . 2]" 76 . 1 76 MET N 1 76 MET CA 1 76 MET C 1 77 CYS N -46.17 -40.61 -42.70 -46.04 -40.36 0.25 20 0 "[ . 1 . 2]" 77 . 1 76 MET C 1 77 CYS N 1 77 CYS CA 1 77 CYS C -66.96 -58.44 -61.60 -64.81 -58.34 0.10 5 0 "[ . 1 . 2]" 78 . 1 77 CYS N 1 77 CYS CA 1 77 CYS C 1 78 THR N -49.59 -36.25 -46.84 -44.05 -45.88 0.15 5 0 "[ . 1 . 2]" 79 . 1 77 CYS C 1 78 THR N 1 78 THR CA 1 78 THR C -71.88 -63.58 -70.16 -72.38 -66.99 0.50 9 0 "[ . 1 . 2]" 80 . 1 78 THR N 1 78 THR CA 1 78 THR C 1 79 ASN N -50.03 -34.61 -41.25 -49.59 -35.87 . . 0 "[ . 1 . 2]" 81 . 1 78 THR C 1 79 ASN N 1 79 ASN CA 1 79 ASN C -70.42 -60.74 -67.29 -67.90 -69.60 0.14 10 0 "[ . 1 . 2]" 82 . 1 79 ASN N 1 79 ASN CA 1 79 ASN C 1 80 ALA N -50.09 -32.77 -36.80 -43.81 -32.74 0.03 18 0 "[ . 1 . 2]" 83 . 1 79 ASN C 1 80 ALA N 1 80 ALA CA 1 80 ALA C -74.45 -60.29 -71.26 -71.19 -71.45 0.15 11 0 "[ . 1 . 2]" 84 . 1 80 ALA N 1 80 ALA CA 1 80 ALA C 1 81 MET N -42.43 -33.01 -41.30 -42.97 -37.09 0.54 13 0 "[ . 1 . 2]" 85 . 1 80 ALA C 1 81 MET N 1 81 MET CA 1 81 MET C -83.58 -58.36 -70.93 -70.91 -72.21 . . 0 "[ . 1 . 2]" 86 . 1 89 ILE C 1 90 TYR N 1 90 TYR CA 1 90 TYR C -73.01 -58.87 -65.20 -73.05 -58.98 0.04 17 0 "[ . 1 . 2]" 87 . 1 90 TYR N 1 90 TYR CA 1 90 TYR C 1 91 TYR N -46.57 -30.77 -46.96 -46.11 -46.67 0.94 14 0 "[ . 1 . 2]" 88 . 1 90 TYR C 1 91 TYR N 1 91 TYR CA 1 91 TYR C -65.24 -54.24 -64.62 -64.13 -64.55 0.24 11 0 "[ . 1 . 2]" 89 . 1 91 TYR N 1 91 TYR CA 1 91 TYR C 1 92 LYS N -49.80 -40.64 -47.00 -48.47 -48.65 . . 0 "[ . 1 . 2]" 90 . 1 91 TYR C 1 92 LYS N 1 92 LYS CA 1 92 LYS C -69.93 -58.51 -64.96 -70.04 -60.04 0.11 6 0 "[ . 1 . 2]" 91 . 1 92 LYS N 1 92 LYS CA 1 92 LYS C 1 93 ALA N -47.30 -34.18 -38.01 -43.66 -34.46 . . 0 "[ . 1 . 2]" 92 . 1 92 LYS C 1 93 ALA N 1 93 ALA CA 1 93 ALA C -68.70 -57.62 -59.24 -58.65 -59.61 0.28 18 0 "[ . 1 . 2]" 93 . 1 93 ALA N 1 93 ALA CA 1 93 ALA C 1 94 ALA N -46.63 -34.77 -45.94 -47.21 -43.67 0.58 2 0 "[ . 1 . 2]" 94 . 1 93 ALA C 1 94 ALA N 1 94 ALA CA 1 94 ALA C -72.67 -61.15 -66.11 -69.98 -61.91 . . 0 "[ . 1 . 2]" 95 . 1 94 ALA N 1 94 ALA CA 1 94 ALA C 1 95 LYS N -45.43 -38.87 -43.41 -43.56 -44.26 0.42 8 0 "[ . 1 . 2]" 96 . 1 94 ALA C 1 95 LYS N 1 95 LYS CA 1 95 LYS C -72.42 -58.44 -64.76 -62.08 -62.83 . . 0 "[ . 1 . 2]" 97 . 1 95 LYS N 1 95 LYS CA 1 95 LYS C 1 96 LYS N -47.82 -29.06 -46.02 -47.91 -47.95 0.36 11 0 "[ . 1 . 2]" 98 . 1 95 LYS C 1 96 LYS N 1 96 LYS CA 1 96 LYS C -70.43 -60.67 -61.41 -65.47 -60.37 0.30 16 0 "[ . 1 . 2]" 99 . 1 96 LYS N 1 96 LYS CA 1 96 LYS C 1 97 LEU N -51.09 -26.75 -44.44 -49.81 -38.78 . . 0 "[ . 1 . 2]" 100 . 1 96 LYS C 1 97 LEU N 1 97 LEU CA 1 97 LEU C -70.16 -62.98 -63.60 -63.21 -63.44 0.44 17 0 "[ . 1 . 2]" 101 . 1 97 LEU N 1 97 LEU CA 1 97 LEU C 1 98 LEU N -47.75 -26.21 -38.59 -42.14 -42.61 . . 0 "[ . 1 . 2]" 102 . 1 97 LEU C 1 98 LEU N 1 98 LEU CA 1 98 LEU C -66.47 -54.31 -59.45 -64.63 -54.14 0.17 20 0 "[ . 1 . 2]" 103 . 1 98 LEU N 1 98 LEU CA 1 98 LEU C 1 99 HIS N -45.48 -34.88 -44.86 -43.57 -44.98 0.51 16 0 "[ . 1 . 2]" 104 . 1 98 LEU C 1 99 HIS N 1 99 HIS CA 1 99 HIS C -66.08 -60.82 -63.68 -60.63 -61.24 0.49 7 0 "[ . 1 . 2]" 105 . 1 99 HIS N 1 99 HIS CA 1 99 HIS C 1 100 SER N -43.88 -35.28 -42.11 -44.45 -35.45 0.57 4 0 "[ . 1 . 2]" 106 . 1 99 HIS C 1 100 SER N 1 100 SER CA 1 100 SER C -71.30 -58.26 -65.47 -71.45 -57.92 0.34 6 0 "[ . 1 . 2]" 107 . 1 100 SER N 1 100 SER CA 1 100 SER C 1 101 GLY N -47.37 -31.99 -42.98 -42.13 -43.58 0.33 13 0 "[ . 1 . 2]" 108 . 1 100 SER C 1 101 GLY N 1 101 GLY CA 1 101 GLY C -68.53 -55.75 -63.52 -68.89 -56.74 0.36 7 0 "[ . 1 . 2]" 109 . 1 101 GLY N 1 101 GLY CA 1 101 GLY C 1 102 MET N -48.28 -32.48 -38.35 -48.54 -32.39 0.26 16 0 "[ . 1 . 2]" 110 . 1 101 GLY C 1 102 MET N 1 102 MET CA 1 102 MET C -70.26 -55.00 -65.61 -70.41 -58.38 0.15 15 0 "[ . 1 . 2]" 111 . 1 102 MET N 1 102 MET CA 1 102 MET C 1 103 LYS N -48.50 -27.74 -44.12 -44.87 -46.47 0.13 17 0 "[ . 1 . 2]" 112 . 1 102 MET C 1 103 LYS N 1 103 LYS CA 1 103 LYS C -73.82 -61.28 -64.60 -70.70 -60.89 0.39 16 0 "[ . 1 . 2]" 113 . 1 103 LYS N 1 103 LYS CA 1 103 LYS C 1 104 ILE N -46.91 -29.37 -44.81 -47.75 -37.71 0.84 15 0 "[ . 1 . 2]" 114 . 1 103 LYS C 1 104 ILE N 1 104 ILE CA 1 104 ILE C -76.70 -57.24 -66.04 -63.82 -65.29 . . 0 "[ . 1 . 2]" 115 . 1 104 ILE N 1 104 ILE CA 1 104 ILE C 1 105 LEU N -48.23 -35.23 -37.33 -40.28 -34.71 0.52 9 0 "[ . 1 . 2]" stop_ save_
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