NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
610642 | 2n9g | 25905 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2n9g save_dihedral_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 1485 _TA_constraint_stats_list.Viol_total 19742.09 _TA_constraint_stats_list.Viol_max 4.54 _TA_constraint_stats_list.Viol_rms 0.57 _TA_constraint_stats_list.Viol_average_all_restraints 0.31 _TA_constraint_stats_list.Viol_average_violations_only 0.66 _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 4 ASN C 1 5 GLU N 1 5 GLU CA 1 5 GLU C -89.51 -56.19 -69.27 -86.64 -56.22 . . 0 "[ . 1 . 2]" 2 . 1 5 GLU N 1 5 GLU CA 1 5 GLU C 1 6 ARG N -49.46 -6.16 -35.92 -49.44 -22.79 . . 0 "[ . 1 . 2]" 3 . 1 9 SER C 1 10 PHE N 1 10 PHE CA 1 10 PHE C -127.63 -98.79 -116.33 -102.26 -107.43 0.33 17 0 "[ . 1 . 2]" 4 . 1 10 PHE N 1 10 PHE CA 1 10 PHE C 1 11 ASN N 118.05 159.29 129.60 123.61 121.00 0.26 20 0 "[ . 1 . 2]" 5 . 1 10 PHE C 1 11 ASN N 1 11 ASN CA 1 11 ASN C -103.82 -81.02 -102.86 -104.32 -96.24 0.50 12 0 "[ . 1 . 2]" 6 . 1 11 ASN N 1 11 ASN CA 1 11 ASN C 1 12 LYS N 78.83 111.99 89.90 90.18 80.71 0.96 13 0 "[ . 1 . 2]" 7 . 1 11 ASN C 1 12 LYS N 1 12 LYS CA 1 12 LYS C -64.53 -53.03 -56.58 -52.58 -52.82 0.94 13 0 "[ . 1 . 2]" 8 . 1 12 LYS N 1 12 LYS CA 1 12 LYS C 1 13 ASN N -46.49 -34.19 -33.62 -34.05 -32.19 2.00 17 0 "[ . 1 . 2]" 9 . 1 12 LYS C 1 13 ASN N 1 13 ASN CA 1 13 ASN C -62.34 -57.82 -57.26 -57.26 -57.35 2.02 17 0 "[ . 1 . 2]" 10 . 1 13 ASN N 1 13 ASN CA 1 13 ASN C 1 14 GLY N -49.23 -31.63 -39.66 -48.29 -31.60 0.03 17 0 "[ . 1 . 2]" 11 . 1 13 ASN C 1 14 GLY N 1 14 GLY CA 1 14 GLY C -74.69 -57.95 -63.10 -60.59 -62.03 0.13 8 0 "[ . 1 . 2]" 12 . 1 14 GLY N 1 14 GLY CA 1 14 GLY C 1 15 CYS N -47.95 -36.37 -40.32 -48.49 -36.05 0.54 17 0 "[ . 1 . 2]" 13 . 1 14 GLY C 1 15 CYS N 1 15 CYS CA 1 15 CYS C -66.56 -59.54 -68.79 -69.13 -69.20 3.51 10 0 "[ . 1 . 2]" 14 . 1 15 CYS N 1 15 CYS CA 1 15 CYS C 1 16 LEU N -46.73 -36.49 -42.62 -47.13 -37.73 0.40 18 0 "[ . 1 . 2]" 15 . 1 15 CYS C 1 16 LEU N 1 16 LEU CA 1 16 LEU C -73.78 -59.56 -62.81 -64.58 -65.26 1.09 17 0 "[ . 1 . 2]" 16 . 1 16 LEU N 1 16 LEU CA 1 16 LEU C 1 17 VAL N -44.70 -22.14 -45.97 -47.92 -40.97 3.22 13 0 "[ . 1 . 2]" 17 . 1 16 LEU C 1 17 VAL N 1 17 VAL CA 1 17 VAL C -67.59 -57.03 -68.11 -68.00 -68.05 2.02 13 0 "[ . 1 . 2]" 18 . 1 17 VAL N 1 17 VAL CA 1 17 VAL C 1 18 PHE N -48.51 -38.95 -36.22 -38.20 -34.41 4.54 10 0 "[ . 1 . 2]" 19 . 1 17 VAL C 1 18 PHE N 1 18 PHE CA 1 18 PHE C -64.63 -56.31 -62.51 -63.59 -64.16 0.45 7 0 "[ . 1 . 2]" 20 . 1 18 PHE N 1 18 PHE CA 1 18 PHE C 1 19 VAL N -63.25 -34.47 -55.69 -63.04 -44.39 . . 0 "[ . 1 . 2]" 21 . 1 18 PHE C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -69.59 -60.49 -63.65 -60.73 -60.97 0.58 15 0 "[ . 1 . 2]" 22 . 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 SER N -47.89 -35.39 -41.14 -37.60 -38.10 . . 0 "[ . 1 . 2]" 23 . 1 19 VAL C 1 20 SER N 1 20 SER CA 1 20 SER C -65.09 -57.29 -58.81 -61.37 -61.90 1.10 12 0 "[ . 1 . 2]" 24 . 1 20 SER N 1 20 SER CA 1 20 SER C 1 21 ARG N -48.60 -40.42 -48.58 -49.50 -49.62 1.61 19 0 "[ . 1 . 2]" 25 . 1 20 SER C 1 21 ARG N 1 21 ARG CA 1 21 ARG C -68.19 -60.75 -68.15 -68.77 -68.87 1.40 17 0 "[ . 1 . 2]" 26 . 1 21 ARG N 1 21 ARG CA 1 21 ARG C 1 22 LEU N -47.63 -38.99 -37.82 -38.26 -38.28 2.85 19 0 "[ . 1 . 2]" 27 . 1 21 ARG C 1 22 LEU N 1 22 LEU CA 1 22 LEU C -73.21 -60.27 -59.35 -59.66 -59.82 2.60 17 0 "[ . 1 . 2]" 28 . 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 TRP N -47.04 -31.42 -43.87 -47.39 -36.88 0.35 4 0 "[ . 1 . 2]" 29 . 1 22 LEU C 1 23 TRP N 1 23 TRP CA 1 23 TRP C -65.06 -56.04 -60.57 -61.00 -61.80 1.56 4 0 "[ . 1 . 2]" 30 . 1 23 TRP N 1 23 TRP CA 1 23 TRP C 1 24 ASP N -51.77 -37.27 -36.98 -42.14 -35.68 1.59 15 0 "[ . 1 . 2]" 31 . 1 24 ASP C 1 25 LEU N 1 25 LEU CA 1 25 LEU C -92.38 -58.68 -59.21 -73.88 -57.78 0.90 15 0 "[ . 1 . 2]" 32 . 1 25 LEU N 1 25 LEU CA 1 25 LEU C 1 26 ASP N -51.36 -1.96 -35.56 -37.66 -45.62 0.24 1 0 "[ . 1 . 2]" 33 . 1 25 LEU C 1 26 ASP N 1 26 ASP CA 1 26 ASP C -138.77 -74.13 -76.72 -139.77 -72.79 1.34 20 0 "[ . 1 . 2]" 34 . 1 26 ASP N 1 26 ASP CA 1 26 ASP C 1 27 LYS N 75.10 113.10 84.19 74.90 113.98 0.88 15 0 "[ . 1 . 2]" 35 . 1 27 LYS N 1 27 LYS CA 1 27 LYS C 1 28 LEU N -49.33 -29.77 -31.89 -33.26 -35.59 1.01 15 0 "[ . 1 . 2]" 36 . 1 30 MET C 1 31 PHE N 1 31 PHE CA 1 31 PHE C -128.30 -76.76 -110.54 -127.27 -92.88 . . 0 "[ . 1 . 2]" 37 . 1 31 PHE N 1 31 PHE CA 1 31 PHE C 1 32 HIS N 119.38 -177.00 121.67 118.88 118.85 1.54 15 0 "[ . 1 . 2]" 38 . 1 32 HIS C 1 33 HIS N 1 33 HIS CA 1 33 HIS C -152.58 -116.78 -153.57 -154.50 -152.87 1.92 15 0 "[ . 1 . 2]" 39 . 1 33 HIS N 1 33 HIS CA 1 33 HIS C 1 34 PRO N 138.80 163.14 156.84 156.25 155.80 . . 0 "[ . 1 . 2]" 40 . 1 34 PRO N 1 34 PRO CA 1 34 PRO C 1 35 VAL N 116.37 147.99 146.76 148.44 148.30 0.83 14 0 "[ . 1 . 2]" 41 . 1 34 PRO C 1 35 VAL N 1 35 VAL CA 1 35 VAL C -101.56 -71.64 -72.36 -71.82 -73.33 0.67 15 0 "[ . 1 . 2]" 42 . 1 35 VAL N 1 35 VAL CA 1 35 VAL C 1 36 SER N 117.46 144.38 143.91 128.65 145.21 0.83 1 0 "[ . 1 . 2]" 43 . 1 35 VAL C 1 36 SER N 1 36 SER CA 1 36 SER C -134.68 -79.12 -79.06 -82.87 -78.30 0.82 1 0 "[ . 1 . 2]" 44 . 1 36 SER N 1 36 SER CA 1 36 SER C 1 37 ALA N 109.60 140.90 137.97 140.92 139.93 0.32 3 0 "[ . 1 . 2]" 45 . 1 36 SER C 1 37 ALA N 1 37 ALA CA 1 37 ALA C -65.25 -55.75 -62.50 -62.09 -65.05 0.20 15 0 "[ . 1 . 2]" 46 . 1 37 ALA N 1 37 ALA CA 1 37 ALA C 1 38 GLU N -34.48 -16.64 -33.37 -34.07 -34.52 0.63 1 0 "[ . 1 . 2]" 47 . 1 38 GLU C 1 39 GLU N 1 39 GLU CA 1 39 GLU C -91.62 -69.04 -92.04 -92.18 -92.27 1.00 1 0 "[ . 1 . 2]" 48 . 1 39 GLU N 1 39 GLU CA 1 39 GLU C 1 40 LEU N -51.62 -10.22 -33.59 -51.65 -26.16 0.03 9 0 "[ . 1 . 2]" 49 . 1 39 GLU C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -133.87 -84.99 -124.31 -133.82 -112.30 . . 0 "[ . 1 . 2]" 50 . 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 PRO N 62.53 93.91 78.41 75.77 82.00 . . 0 "[ . 1 . 2]" 51 . 1 41 PRO N 1 41 PRO CA 1 41 PRO C 1 42 ASP N -27.84 -16.16 -16.38 -21.14 -15.72 0.44 1 0 "[ . 1 . 2]" 52 . 1 41 PRO C 1 42 ASP N 1 42 ASP CA 1 42 ASP C -116.32 -88.92 -111.47 -112.53 -113.70 . . 0 "[ . 1 . 2]" 53 . 1 42 ASP N 1 42 ASP CA 1 42 ASP C 1 43 TYR N 1.04 33.00 19.24 10.91 23.07 . . 0 "[ . 1 . 2]" 54 . 1 42 ASP C 1 43 TYR N 1 43 TYR CA 1 43 TYR C -60.19 -51.05 -53.76 -60.48 -51.34 0.29 9 0 "[ . 1 . 2]" 55 . 1 43 TYR N 1 43 TYR CA 1 43 TYR C 1 44 HIS N -55.37 -35.25 -34.52 -43.94 -32.51 2.74 13 0 "[ . 1 . 2]" 56 . 1 43 TYR C 1 44 HIS N 1 44 HIS CA 1 44 HIS C -76.82 -55.20 -63.41 -64.79 -65.32 1.12 9 0 "[ . 1 . 2]" 57 . 1 44 HIS N 1 44 HIS CA 1 44 HIS C 1 45 THR N -42.54 -15.48 -37.16 -42.93 -32.08 0.39 13 0 "[ . 1 . 2]" 58 . 1 44 HIS C 1 45 THR N 1 45 THR CA 1 45 THR C -86.17 -64.89 -86.70 -86.50 -86.55 2.74 3 0 "[ . 1 . 2]" 59 . 1 45 THR N 1 45 THR CA 1 45 THR C 1 46 VAL N -45.17 -11.57 -17.58 -23.54 -43.93 1.75 3 0 "[ . 1 . 2]" 60 . 1 45 THR C 1 46 VAL N 1 46 VAL CA 1 46 VAL C -96.05 -70.23 -87.18 -96.59 -69.38 0.85 1 0 "[ . 1 . 2]" 61 . 1 46 VAL N 1 46 VAL CA 1 46 VAL C 1 47 ILE N -51.94 -16.92 -51.15 -53.57 -23.97 1.63 3 0 "[ . 1 . 2]" 62 . 1 48 LYS C 1 49 ARG N 1 49 ARG CA 1 49 ARG C -126.27 -80.07 -109.69 -106.03 -126.24 1.09 7 0 "[ . 1 . 2]" 63 . 1 49 ARG N 1 49 ARG CA 1 49 ARG C 1 50 PRO N 97.14 160.58 99.91 94.90 138.06 2.24 15 0 "[ . 1 . 2]" 64 . 1 50 PRO C 1 51 VAL N 1 51 VAL CA 1 51 VAL C -146.41 -77.69 -132.43 -146.65 -109.98 0.24 9 0 "[ . 1 . 2]" 65 . 1 51 VAL N 1 51 VAL CA 1 51 VAL C 1 52 ASP N 129.72 158.36 132.35 128.46 144.22 1.26 9 0 "[ . 1 . 2]" 66 . 1 51 VAL C 1 52 ASP N 1 52 ASP CA 1 52 ASP C -145.52 -83.32 -137.99 -128.07 -129.18 1.17 9 0 "[ . 1 . 2]" 67 . 1 52 ASP N 1 52 ASP CA 1 52 ASP C 1 53 LEU N 155.46 -177.88 155.42 154.89 154.70 1.19 3 0 "[ . 1 . 2]" 68 . 1 52 ASP C 1 53 LEU N 1 53 LEU CA 1 53 LEU C -77.90 -53.50 -69.12 -78.44 -53.14 0.54 2 0 "[ . 1 . 2]" 69 . 1 53 LEU N 1 53 LEU CA 1 53 LEU C 1 54 SER N -43.27 -28.95 -42.59 -45.09 -32.18 1.82 16 0 "[ . 1 . 2]" 70 . 1 53 LEU C 1 54 SER N 1 54 SER CA 1 54 SER C -66.73 -57.21 -67.09 -68.61 -58.17 1.88 8 0 "[ . 1 . 2]" 71 . 1 54 SER N 1 54 SER CA 1 54 SER C 1 55 SER N -47.16 -38.32 -37.85 -41.10 -36.11 2.21 1 0 "[ . 1 . 2]" 72 . 1 54 SER C 1 55 SER N 1 55 SER CA 1 55 SER C -74.45 -60.63 -60.94 -63.44 -71.99 1.41 9 0 "[ . 1 . 2]" 73 . 1 55 SER N 1 55 SER CA 1 55 SER C 1 56 ILE N -49.81 -30.35 -47.29 -50.59 -35.24 0.78 17 0 "[ . 1 . 2]" 74 . 1 55 SER C 1 56 ILE N 1 56 ILE CA 1 56 ILE C -70.66 -62.30 -65.97 -66.77 -69.24 0.61 1 0 "[ . 1 . 2]" 75 . 1 56 ILE N 1 56 ILE CA 1 56 ILE C 1 57 ARG N -46.04 -39.16 -46.78 -48.28 -49.06 3.02 1 0 "[ . 1 . 2]" 76 . 1 56 ILE C 1 57 ARG N 1 57 ARG CA 1 57 ARG C -67.03 -53.83 -58.87 -59.08 -60.16 0.56 10 0 "[ . 1 . 2]" 77 . 1 57 ARG N 1 57 ARG CA 1 57 ARG C 1 58 ASP N -49.95 -40.43 -40.12 -44.61 -38.21 2.22 1 0 "[ . 1 . 2]" 78 . 1 57 ARG C 1 58 ASP N 1 58 ASP CA 1 58 ASP C -71.99 -60.03 -72.56 -72.33 -72.39 1.50 1 0 "[ . 1 . 2]" 79 . 1 58 ASP N 1 58 ASP CA 1 58 ASP C 1 59 GLY N -49.91 -34.39 -36.92 -40.14 -33.32 1.07 1 0 "[ . 1 . 2]" 80 . 1 58 ASP C 1 59 GLY N 1 59 GLY CA 1 59 GLY C -65.88 -59.94 -63.36 -64.03 -64.74 0.72 1 0 "[ . 1 . 2]" 81 . 1 59 GLY N 1 59 GLY CA 1 59 GLY C 1 60 ILE N -48.81 -36.21 -45.89 -45.01 -45.85 0.49 1 0 "[ . 1 . 2]" 82 . 1 59 GLY C 1 60 ILE N 1 60 ILE CA 1 60 ILE C -66.68 -59.72 -65.73 -59.74 -66.77 1.62 15 0 "[ . 1 . 2]" 83 . 1 60 ILE N 1 60 ILE CA 1 60 ILE C 1 61 GLU N -49.67 -41.13 -43.07 -50.17 -39.87 1.26 10 0 "[ . 1 . 2]" 84 . 1 60 ILE C 1 61 GLU N 1 61 GLU CA 1 61 GLU C -65.63 -58.67 -65.03 -66.69 -62.21 1.06 18 0 "[ . 1 . 2]" 85 . 1 61 GLU N 1 61 GLU CA 1 61 GLU C 1 62 LYS N -43.31 -26.35 -33.07 -32.70 -33.71 1.62 18 0 "[ . 1 . 2]" 86 . 1 61 GLU C 1 62 LYS N 1 62 LYS CA 1 62 LYS C -100.41 -78.07 -81.28 -78.37 -78.52 2.02 18 0 "[ . 1 . 2]" 87 . 1 62 LYS N 1 62 LYS CA 1 62 LYS C 1 63 GLY N -32.29 -4.89 -21.92 -24.12 -24.62 1.24 18 0 "[ . 1 . 2]" 88 . 1 62 LYS C 1 63 GLY N 1 63 GLY CA 1 63 GLY C 72.80 92.00 90.15 92.12 92.10 2.38 18 0 "[ . 1 . 2]" 89 . 1 63 GLY N 1 63 GLY CA 1 63 GLY C 1 64 THR N 5.42 25.66 27.72 28.15 28.08 2.86 11 0 "[ . 1 . 2]" 90 . 1 67 THR C 1 68 ASP N 1 68 ASP CA 1 68 ASP C -74.25 -60.73 -59.52 -59.12 -59.21 2.39 16 0 "[ . 1 . 2]" 91 . 1 68 ASP N 1 68 ASP CA 1 68 ASP C 1 69 VAL N -43.15 -24.31 -31.56 -41.74 -23.97 0.34 18 0 "[ . 1 . 2]" 92 . 1 68 ASP C 1 69 VAL N 1 69 VAL CA 1 69 VAL C -71.52 -59.98 -67.87 -65.19 -67.03 0.21 13 0 "[ . 1 . 2]" 93 . 1 69 VAL N 1 69 VAL CA 1 69 VAL C 1 70 ASP N -49.95 -36.47 -49.95 -47.75 -49.06 1.74 18 0 "[ . 1 . 2]" 94 . 1 69 VAL C 1 70 ASP N 1 70 ASP CA 1 70 ASP C -65.09 -54.93 -61.73 -65.10 -56.84 0.01 18 0 "[ . 1 . 2]" 95 . 1 70 ASP N 1 70 ASP CA 1 70 ASP C 1 71 VAL N -48.10 -34.10 -41.03 -40.64 -41.30 . . 0 "[ . 1 . 2]" 96 . 1 70 ASP C 1 71 VAL N 1 71 VAL CA 1 71 VAL C -73.00 -61.90 -65.71 -68.23 -61.57 0.33 16 0 "[ . 1 . 2]" 97 . 1 71 VAL N 1 71 VAL CA 1 71 VAL C 1 72 GLN N -51.44 -36.34 -43.62 -43.34 -43.81 . . 0 "[ . 1 . 2]" 98 . 1 71 VAL C 1 72 GLN N 1 72 GLN CA 1 72 GLN C -62.61 -56.65 -62.27 -63.31 -60.16 0.70 17 0 "[ . 1 . 2]" 99 . 1 72 GLN N 1 72 GLN CA 1 72 GLN C 1 73 ASN N -47.40 -39.94 -43.71 -47.48 -47.55 0.63 3 0 "[ . 1 . 2]" 100 . 1 72 GLN C 1 73 ASN N 1 73 ASN CA 1 73 ASN C -69.95 -59.09 -65.41 -70.29 -60.91 0.34 19 0 "[ . 1 . 2]" 101 . 1 73 ASN N 1 73 ASN CA 1 73 ASN C 1 74 ASP N -44.55 -31.85 -42.01 -41.91 -44.77 0.75 18 0 "[ . 1 . 2]" 102 . 1 73 ASN C 1 74 ASP N 1 74 ASP CA 1 74 ASP C -69.04 -56.58 -61.45 -65.67 -58.21 . . 0 "[ . 1 . 2]" 103 . 1 74 ASP N 1 74 ASP CA 1 74 ASP C 1 75 VAL N -49.06 -30.82 -49.93 -52.01 -45.05 2.95 20 0 "[ . 1 . 2]" 104 . 1 74 ASP C 1 75 VAL N 1 75 VAL CA 1 75 VAL C -69.17 -57.83 -61.60 -64.29 -57.91 . . 0 "[ . 1 . 2]" 105 . 1 75 VAL N 1 75 VAL CA 1 75 VAL C 1 76 ALA N -45.70 -39.16 -41.64 -41.05 -41.96 0.80 11 0 "[ . 1 . 2]" 106 . 1 75 VAL C 1 76 ALA N 1 76 ALA CA 1 76 ALA C -66.12 -57.50 -60.35 -66.19 -56.86 0.64 18 0 "[ . 1 . 2]" 107 . 1 76 ALA N 1 76 ALA CA 1 76 ALA C 1 77 ARG N -46.98 -34.70 -44.87 -44.21 -46.83 0.94 12 0 "[ . 1 . 2]" 108 . 1 76 ALA C 1 77 ARG N 1 77 ARG CA 1 77 ARG C -70.60 -60.66 -65.55 -72.06 -59.88 1.46 17 0 "[ . 1 . 2]" 109 . 1 77 ARG N 1 77 ARG CA 1 77 ARG C 1 78 MET N -49.33 -37.71 -39.44 -37.67 -40.80 2.39 11 0 "[ . 1 . 2]" 110 . 1 77 ARG C 1 78 MET N 1 78 MET CA 1 78 MET C -66.82 -60.24 -63.11 -67.47 -58.82 1.42 5 0 "[ . 1 . 2]" 111 . 1 78 MET N 1 78 MET CA 1 78 MET C 1 79 ILE N -46.09 -37.35 -44.44 -48.91 -38.55 2.82 17 0 "[ . 1 . 2]" 112 . 1 78 MET C 1 79 ILE N 1 79 ILE CA 1 79 ILE C -66.56 -58.54 -66.59 -68.40 -61.33 1.84 8 0 "[ . 1 . 2]" 113 . 1 79 ILE N 1 79 ILE CA 1 79 ILE C 1 80 THR N -48.13 -38.17 -40.64 -39.81 -41.33 1.45 2 0 "[ . 1 . 2]" 114 . 1 79 ILE C 1 80 THR N 1 80 THR CA 1 80 THR C -78.01 -56.61 -62.60 -67.66 -56.48 0.13 19 0 "[ . 1 . 2]" 115 . 1 80 THR N 1 80 THR CA 1 80 THR C 1 81 ASN N -45.90 -33.46 -46.43 -47.71 -42.90 1.81 3 0 "[ . 1 . 2]" 116 . 1 80 THR C 1 81 ASN N 1 81 ASN CA 1 81 ASN C -69.86 -63.20 -66.77 -70.57 -62.87 0.71 18 0 "[ . 1 . 2]" 117 . 1 81 ASN N 1 81 ASN CA 1 81 ASN C 1 82 ALA N -46.94 -36.12 -39.97 -37.38 -40.31 0.74 15 0 "[ . 1 . 2]" 118 . 1 82 ALA C 1 83 LEU N 1 83 LEU CA 1 83 LEU C -77.84 -56.72 -69.96 -78.28 -56.46 0.44 18 0 "[ . 1 . 2]" 119 . 1 83 LEU N 1 83 LEU CA 1 83 LEU C 1 84 GLU N -43.99 -28.61 -36.09 -35.73 -37.85 0.60 17 0 "[ . 1 . 2]" 120 . 1 83 LEU C 1 84 GLU N 1 84 GLU CA 1 84 GLU C -80.35 -64.21 -65.36 -64.11 -64.22 0.70 13 0 "[ . 1 . 2]" 121 . 1 84 GLU N 1 84 GLU CA 1 84 GLU C 1 85 TYR N -50.16 -28.24 -37.05 -50.37 -28.10 0.21 18 0 "[ . 1 . 2]" 122 . 1 84 GLU C 1 85 TYR N 1 85 TYR CA 1 85 TYR C -86.64 -71.46 -84.62 -87.07 -71.29 0.43 3 0 "[ . 1 . 2]" 123 . 1 85 TYR N 1 85 TYR CA 1 85 TYR C 1 86 ASN N -39.60 -12.86 -28.22 -36.53 -37.09 . . 0 "[ . 1 . 2]" 124 . 1 85 TYR C 1 86 ASN N 1 86 ASN CA 1 86 ASN C -115.59 -74.85 -82.55 -81.40 -83.47 0.65 16 0 "[ . 1 . 2]" 125 . 1 86 ASN N 1 86 ASN CA 1 86 ASN C 1 87 ALA N -50.34 0.58 -7.29 -22.76 2.14 1.56 10 0 "[ . 1 . 2]" 126 . 1 86 ASN C 1 87 ALA N 1 87 ALA CA 1 87 ALA C -102.98 -68.48 -68.27 -68.90 -66.75 1.73 10 0 "[ . 1 . 2]" 127 . 1 87 ALA N 1 87 ALA CA 1 87 ALA C 1 88 LYS N 95.48 152.94 95.72 94.61 99.26 0.87 8 0 "[ . 1 . 2]" 128 . 1 90 SER C 1 91 THR N 1 91 THR CA 1 91 THR C -64.79 -52.79 -61.91 -65.67 -51.48 1.31 10 0 "[ . 1 . 2]" 129 . 1 91 THR N 1 91 THR CA 1 91 THR C 1 92 TRP N -45.43 -28.71 -33.27 -45.45 -27.49 1.22 10 0 "[ . 1 . 2]" 130 . 1 91 THR C 1 92 TRP N 1 92 TRP CA 1 92 TRP C -71.60 -55.30 -61.23 -55.71 -59.62 0.16 4 0 "[ . 1 . 2]" 131 . 1 92 TRP N 1 92 TRP CA 1 92 TRP C 1 93 TYR N -50.74 -33.44 -39.88 -49.17 -34.04 . . 0 "[ . 1 . 2]" 132 . 1 92 TRP C 1 93 TYR N 1 93 TYR CA 1 93 TYR C -65.51 -55.91 -62.96 -60.05 -62.73 2.24 17 0 "[ . 1 . 2]" 133 . 1 93 TYR N 1 93 TYR CA 1 93 TYR C 1 94 GLN N -50.16 -40.16 -44.31 -45.56 -47.40 1.39 10 0 "[ . 1 . 2]" 134 . 1 93 TYR C 1 94 GLN N 1 94 GLN CA 1 94 GLN C -70.01 -50.91 -65.76 -64.74 -65.11 0.05 12 0 "[ . 1 . 2]" 135 . 1 94 GLN N 1 94 GLN CA 1 94 GLN C 1 95 GLU N -46.41 -37.67 -41.32 -40.62 -42.33 1.37 17 0 "[ . 1 . 2]" 136 . 1 94 GLN C 1 95 GLU N 1 95 GLU CA 1 95 GLU C -69.60 -61.04 -63.14 -66.00 -60.80 0.24 15 0 "[ . 1 . 2]" 137 . 1 95 GLU N 1 95 GLU CA 1 95 GLU C 1 96 ALA N -46.47 -37.89 -44.43 -46.98 -35.68 2.21 17 0 "[ . 1 . 2]" 138 . 1 95 GLU C 1 96 ALA N 1 96 ALA CA 1 96 ALA C -67.28 -61.20 -66.22 -66.23 -67.12 0.90 19 0 "[ . 1 . 2]" 139 . 1 96 ALA N 1 96 ALA CA 1 96 ALA C 1 97 MET N -46.33 -36.89 -42.09 -42.64 -43.42 0.72 10 0 "[ . 1 . 2]" 140 . 1 96 ALA C 1 97 MET N 1 97 MET CA 1 97 MET C -74.35 -59.85 -68.11 -71.92 -65.00 . . 0 "[ . 1 . 2]" 141 . 1 97 MET N 1 97 MET CA 1 97 MET C 1 98 SER N -45.07 -36.65 -39.82 -36.78 -37.03 0.16 16 0 "[ . 1 . 2]" 142 . 1 97 MET C 1 98 SER N 1 98 SER CA 1 98 SER C -68.82 -58.46 -66.24 -69.02 -59.55 0.20 2 0 "[ . 1 . 2]" 143 . 1 98 SER N 1 98 SER CA 1 98 SER C 1 99 PHE N -42.81 -30.43 -42.60 -42.92 -42.94 0.88 16 0 "[ . 1 . 2]" 144 . 1 98 SER C 1 99 PHE N 1 99 PHE CA 1 99 PHE C -68.83 -58.27 -68.96 -70.60 -67.11 1.77 16 0 "[ . 1 . 2]" 145 . 1 99 PHE N 1 99 PHE CA 1 99 PHE C 1 100 ARG N -49.79 -36.61 -38.83 -46.15 -32.64 3.97 16 0 "[ . 1 . 2]" 146 . 1 99 PHE C 1 100 ARG N 1 100 ARG CA 1 100 ARG C -72.08 -51.06 -58.18 -70.08 -52.84 . . 0 "[ . 1 . 2]" 147 . 1 100 ARG N 1 100 ARG CA 1 100 ARG C 1 101 LYS N -47.71 -25.49 -24.95 -24.83 -24.92 1.24 19 0 "[ . 1 . 2]" 148 . 1 100 ARG C 1 101 LYS N 1 101 LYS CA 1 101 LYS C -88.93 -68.67 -69.80 -75.21 -67.01 1.66 16 0 "[ . 1 . 2]" 149 . 1 101 LYS N 1 101 LYS CA 1 101 LYS C 1 102 THR N -49.38 -21.70 -23.23 -23.95 -24.14 0.50 19 0 "[ . 1 . 2]" 150 . 1 101 LYS C 1 102 THR N 1 102 THR CA 1 102 THR C -114.99 -80.81 -113.78 -115.20 -115.22 0.58 12 0 "[ . 1 . 2]" 151 . 1 102 THR N 1 102 THR CA 1 102 THR C 1 103 TYR N -26.95 -9.59 -10.54 -24.71 -8.30 1.29 15 0 "[ . 1 . 2]" 152 . 1 102 THR C 1 103 TYR N 1 103 TYR CA 1 103 TYR C -69.10 -48.28 -64.35 -61.43 -62.51 . . 0 "[ . 1 . 2]" 153 . 1 103 TYR N 1 103 TYR CA 1 103 TYR C 1 104 LEU N -52.30 -34.28 -54.08 -53.30 -53.38 3.54 13 0 "[ . 1 . 2]" 154 . 1 103 TYR C 1 104 LEU N 1 104 LEU CA 1 104 LEU C -69.54 -56.70 -70.94 -70.47 -70.55 3.06 13 0 "[ . 1 . 2]" 155 . 1 104 LEU N 1 104 LEU CA 1 104 LEU C 1 105 ASP N -46.90 -32.42 -38.26 -39.95 -40.37 . . 0 "[ . 1 . 2]" 156 . 1 104 LEU C 1 105 ASP N 1 105 ASP CA 1 105 ASP C -64.28 -55.90 -58.47 -55.70 -55.75 0.41 17 0 "[ . 1 . 2]" 157 . 1 105 ASP N 1 105 ASP CA 1 105 ASP C 1 106 LEU N -49.57 -37.33 -46.49 -44.15 -46.47 0.41 20 0 "[ . 1 . 2]" 158 . 1 108 ARG C 1 109 GLN N 1 109 GLN CA 1 109 GLN C -71.19 -61.13 -70.00 -71.85 -64.78 0.66 12 0 "[ . 1 . 2]" 159 . 1 109 GLN N 1 109 GLN CA 1 109 GLN C 1 110 SER N -34.36 -15.86 -33.48 -35.53 -24.07 1.17 12 0 "[ . 1 . 2]" 160 . 1 109 GLN C 1 110 SER N 1 110 SER CA 1 110 SER C -102.51 -68.27 -79.48 -102.87 -68.20 0.36 12 0 "[ . 1 . 2]" 161 . 1 110 SER N 1 110 SER CA 1 110 SER C 1 111 GLY N -44.41 1.03 -20.95 -27.22 0.95 . . 0 "[ . 1 . 2]" stop_ save_
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