NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
635269 | 6g8o | 27432 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_6g8o save_dihedral_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 142 _TA_constraint_stats_list.Viol_count 230 _TA_constraint_stats_list.Viol_total 15250.38 _TA_constraint_stats_list.Viol_max 31.43 _TA_constraint_stats_list.Viol_rms 2.31 _TA_constraint_stats_list.Viol_average_all_restraints 0.48 _TA_constraint_stats_list.Viol_average_violations_only 4.42 _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 LEU N 1 5 LEU CA 1 5 LEU CB 1 5 LEU CG 150.00 -150.00 -167.41 -165.81 -166.43 . . 0 "[ . 1 .]" 2 . 1 8 LEU N 1 8 LEU CA 1 8 LEU CB 1 8 LEU CG 150.00 -150.00 -166.90 -170.16 -164.49 . . 0 "[ . 1 .]" 3 . 1 9 LEU N 1 9 LEU CA 1 9 LEU CB 1 9 LEU CG -90.00 -30.00 -85.12 -87.26 -82.74 . . 0 "[ . 1 .]" 4 . 1 14 LEU N 1 14 LEU CA 1 14 LEU CB 1 14 LEU CG -90.00 -30.00 -79.51 -79.13 -79.44 . . 0 "[ . 1 .]" 5 . 1 16 GLU N 1 16 GLU CA 1 16 GLU CB 1 16 GLU CG 30.00 90.00 58.61 55.32 62.87 . . 0 "[ . 1 .]" 6 . 1 17 HIS N 1 17 HIS CA 1 17 HIS CB 1 17 HIS CG -90.00 -30.00 -73.93 -72.76 -74.48 . . 0 "[ . 1 .]" 7 . 1 23 LEU N 1 23 LEU CA 1 23 LEU CB 1 23 LEU CG -90.00 -30.00 -62.44 -60.75 -61.13 . . 0 "[ . 1 .]" 8 . 1 24 ASN N 1 24 ASN CA 1 24 ASN CB 1 24 ASN CG -90.00 -30.00 -78.93 -82.45 -74.39 . . 0 "[ . 1 .]" 9 . 1 26 TYR N 1 26 TYR CA 1 26 TYR CB 1 26 TYR CG -90.00 -30.00 -61.67 -62.34 -62.48 . . 0 "[ . 1 .]" 10 . 1 29 LEU N 1 29 LEU CA 1 29 LEU CB 1 29 LEU CG -90.00 -30.00 -56.83 -56.51 -57.12 . . 0 "[ . 1 .]" 11 . 1 32 PHE N 1 32 PHE CA 1 32 PHE CB 1 32 PHE CG 150.00 -150.00 -170.62 -168.15 -168.71 . . 0 "[ . 1 .]" 12 . 1 34 GLU N 1 34 GLU CA 1 34 GLU CB 1 34 GLU CG -90.00 -30.00 -53.91 -63.39 -43.79 . . 0 "[ . 1 .]" 13 . 1 36 ARG N 1 36 ARG CA 1 36 ARG CB 1 36 ARG CG -90.00 -30.00 -57.95 -64.51 -49.03 . . 0 "[ . 1 .]" 14 . 1 40 LEU N 1 40 LEU CA 1 40 LEU CB 1 40 LEU CG -90.00 -30.00 -92.34 -94.24 -95.35 10.63 4 9 "[* +** * ** - *]" 15 . 1 41 ASN N 1 41 ASN CA 1 41 ASN CB 1 41 ASN CG -90.00 -30.00 -69.21 -74.53 -75.55 . . 0 "[ . 1 .]" 16 . 1 46 MET N 1 46 MET CA 1 46 MET CB 1 46 MET CG -90.00 -30.00 -56.58 -61.78 -48.05 . . 0 "[ . 1 .]" 17 . 1 50 HIS N 1 50 HIS CA 1 50 HIS CB 1 50 HIS CG -90.00 -30.00 -63.89 -62.28 -62.72 . . 0 "[ . 1 .]" 18 . 1 51 ARG N 1 51 ARG CA 1 51 ARG CB 1 51 ARG CG -90.00 -30.00 -74.20 -74.22 -74.55 . . 0 "[ . 1 .]" 19 . 1 53 LYS N 1 53 LYS CA 1 53 LYS CB 1 53 LYS CG -90.00 -30.00 -54.06 -54.15 -54.33 . . 0 "[ . 1 .]" 20 . 1 54 LEU N 1 54 LEU CA 1 54 LEU CB 1 54 LEU CG -90.00 -30.00 -67.40 -70.52 -65.37 . . 0 "[ . 1 .]" 21 . 1 55 LEU N 1 55 LEU CA 1 55 LEU CB 1 55 LEU CG -90.00 -30.00 -81.27 -89.66 -75.11 . . 0 "[ . 1 .]" 22 . 1 60 LEU N 1 60 LEU CA 1 60 LEU CB 1 60 LEU CG -90.00 -30.00 -92.75 -93.06 -93.72 7.45 15 2 "[ . -1 +]" 23 . 1 61 LEU N 1 61 LEU CA 1 61 LEU CB 1 61 LEU CG -90.00 -30.00 -68.05 -64.89 -66.01 . . 0 "[ . 1 .]" 24 . 1 68 CYS N 1 68 CYS CA 1 68 CYS CB 1 68 CYS SG -90.00 -30.00 -64.18 -83.07 -52.28 . . 0 "[ . 1 .]" 25 . 1 3 LYS N 1 3 LYS CA 1 3 LYS C 1 4 THR N -55.05 21.17 -15.96 -22.35 -6.53 . . 0 "[ . 1 .]" 26 . 1 2 PRO C 1 3 LYS N 1 3 LYS CA 1 3 LYS C -128.61 -72.17 -97.82 -108.56 -114.36 . . 0 "[ . 1 .]" 27 . 1 4 THR N 1 4 THR CA 1 4 THR C 1 5 LEU N 147.58 179.52 168.89 163.97 174.59 . . 0 "[ . 1 .]" 28 . 1 3 LYS C 1 4 THR N 1 4 THR CA 1 4 THR C 175.16 -85.60 -125.57 -122.14 -123.41 . . 0 "[ . 1 .]" 29 . 1 5 LEU N 1 5 LEU CA 1 5 LEU C 1 6 HIS N -55.02 -18.10 -49.36 -51.76 -52.01 . . 0 "[ . 1 .]" 30 . 1 4 THR C 1 5 LEU N 1 5 LEU CA 1 5 LEU C -80.91 -50.11 -61.41 -65.49 -57.72 . . 0 "[ . 1 .]" 31 . 1 6 HIS N 1 6 HIS CA 1 6 HIS C 1 7 GLU N -57.08 -27.02 -44.82 -45.90 -46.49 . . 0 "[ . 1 .]" 32 . 1 5 LEU C 1 6 HIS N 1 6 HIS CA 1 6 HIS C -74.88 -44.66 -54.04 -58.06 -51.49 . . 0 "[ . 1 .]" 33 . 1 7 GLU N 1 7 GLU CA 1 7 GLU C 1 8 LEU N -58.70 -27.98 -35.17 -32.41 -33.00 . . 0 "[ . 1 .]" 34 . 1 6 HIS C 1 7 GLU N 1 7 GLU CA 1 7 GLU C -72.01 -55.45 -65.42 -71.60 -58.94 . . 0 "[ . 1 .]" 35 . 1 8 LEU N 1 8 LEU CA 1 8 LEU C 1 9 LEU N -54.88 -29.74 -42.83 -46.61 -38.10 . . 0 "[ . 1 .]" 36 . 1 7 GLU C 1 8 LEU N 1 8 LEU CA 1 8 LEU C -73.75 -52.19 -68.41 -70.30 -66.11 . . 0 "[ . 1 .]" 37 . 1 9 LEU N 1 9 LEU CA 1 9 LEU C 1 10 GLU N -47.97 -28.69 -40.12 -37.23 -38.25 . . 0 "[ . 1 .]" 38 . 1 8 LEU C 1 9 LEU N 1 9 LEU CA 1 9 LEU C -72.81 -47.49 -61.68 -61.93 -62.06 . . 0 "[ . 1 .]" 39 . 1 10 GLU N 1 10 GLU CA 1 10 GLU C 1 11 ARG N -47.78 -32.18 -32.15 -32.00 -33.33 4.17 10 0 "[ . 1 .]" 40 . 1 9 LEU C 1 10 GLU N 1 10 GLU CA 1 10 GLU C -68.40 -60.06 -67.15 -70.09 -63.26 1.69 9 0 "[ . 1 .]" 41 . 1 11 ARG N 1 11 ARG CA 1 11 ARG C 1 12 ILE N -53.26 -11.02 -44.03 -41.44 -42.27 . . 0 "[ . 1 .]" 42 . 1 10 GLU C 1 11 ARG N 1 11 ARG CA 1 11 ARG C -71.07 -52.21 -64.45 -65.23 -65.86 . . 0 "[ . 1 .]" 43 . 1 12 ILE N 1 12 ILE CA 1 12 ILE C 1 13 GLY N -13.51 26.31 -12.79 -15.58 -6.78 2.07 15 0 "[ . 1 .]" 44 . 1 11 ARG C 1 12 ILE N 1 12 ILE CA 1 12 ILE C -118.05 -69.19 -90.98 -98.06 -81.51 . . 0 "[ . 1 .]" 45 . 1 13 GLY N 1 13 GLY CA 1 13 GLY C 1 14 LEU N -11.00 42.96 28.77 28.75 28.28 . . 0 "[ . 1 .]" 46 . 1 12 ILE C 1 13 GLY N 1 13 GLY CA 1 13 GLY C 44.82 121.52 91.92 90.16 89.33 . . 0 "[ . 1 .]" 47 . 1 15 GLU N 1 15 GLU CA 1 15 GLU C 1 16 GLU N -53.82 -18.18 -18.75 -22.32 -14.18 4.00 1 0 "[ . 1 .]" 48 . 1 14 LEU C 1 15 GLU N 1 15 GLU CA 1 15 GLU C -66.39 -49.25 -59.79 -61.41 -63.51 . . 0 "[ . 1 .]" 49 . 1 16 GLU N 1 16 GLU CA 1 16 GLU C 1 17 HIS N -45.49 9.89 -21.45 -21.05 -21.38 . . 0 "[ . 1 .]" 50 . 1 15 GLU C 1 16 GLU N 1 16 GLU CA 1 16 GLU C -80.95 -53.17 -61.66 -61.61 -62.39 . . 0 "[ . 1 .]" 51 . 1 17 HIS N 1 17 HIS CA 1 17 HIS C 1 18 THR N -32.74 43.92 9.52 3.82 14.41 . . 0 "[ . 1 .]" 52 . 1 16 GLU C 1 17 HIS N 1 17 HIS CA 1 17 HIS C -140.06 -64.38 -116.47 -121.22 -109.17 . . 0 "[ . 1 .]" 53 . 1 18 THR N 1 18 THR CA 1 18 THR C 1 19 SER N -62.33 -26.75 -46.99 -45.91 -46.12 . . 0 "[ . 1 .]" 54 . 1 17 HIS C 1 18 THR N 1 18 THR CA 1 18 THR C -71.04 -41.24 -55.42 -57.66 -52.78 . . 0 "[ . 1 .]" 55 . 1 19 SER N 1 19 SER CA 1 19 SER C 1 20 THR N -48.90 -25.10 -37.54 -42.26 -32.67 . . 0 "[ . 1 .]" 56 . 1 18 THR C 1 19 SER N 1 19 SER CA 1 19 SER C -76.27 -52.13 -62.46 -64.72 -57.66 . . 0 "[ . 1 .]" 57 . 1 20 THR N 1 20 THR CA 1 20 THR C 1 21 LEU N -58.06 -27.34 -51.35 -54.52 -48.08 . . 0 "[ . 1 .]" 58 . 1 19 SER C 1 20 THR N 1 20 THR CA 1 20 THR C -84.46 -50.44 -57.18 -56.00 -56.38 . . 0 "[ . 1 .]" 59 . 1 21 LEU N 1 21 LEU CA 1 21 LEU C 1 22 LEU N -57.92 -35.30 -52.24 -50.36 -50.91 . . 0 "[ . 1 .]" 60 . 1 20 THR C 1 21 LEU N 1 21 LEU CA 1 21 LEU C -70.03 -51.21 -61.78 -64.12 -58.33 . . 0 "[ . 1 .]" 61 . 1 22 LEU N 1 22 LEU CA 1 22 LEU C 1 23 LEU N -68.18 -21.38 -46.35 -45.48 -47.39 . . 0 "[ . 1 .]" 62 . 1 21 LEU C 1 22 LEU N 1 22 LEU CA 1 22 LEU C -72.89 -51.27 -53.24 -55.38 -51.06 0.21 13 0 "[ . 1 .]" 63 . 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 ASN N -46.86 -14.32 -28.07 -22.44 -25.39 . . 0 "[ . 1 .]" 64 . 1 22 LEU C 1 23 LEU N 1 23 LEU CA 1 23 LEU C -79.29 -51.33 -69.93 -74.80 -63.23 . . 0 "[ . 1 .]" 65 . 1 24 ASN N 1 24 ASN CA 1 24 ASN C 1 25 GLY N -39.34 40.18 11.72 4.92 18.80 . . 0 "[ . 1 .]" 66 . 1 23 LEU C 1 24 ASN N 1 24 ASN CA 1 24 ASN C -125.91 -62.73 -94.92 -100.95 -89.78 . . 0 "[ . 1 .]" 67 . 1 25 GLY N 1 25 GLY CA 1 25 GLY C 1 26 TYR N -6.94 42.52 -7.25 -12.56 1.54 5.62 15 2 "[ . 1 - +]" 68 . 1 24 ASN C 1 25 GLY N 1 25 GLY CA 1 25 GLY C 60.46 101.90 102.92 100.44 98.68 4.46 14 0 "[ . 1 .]" 69 . 1 27 GLN N 1 27 GLN CA 1 27 GLN C 1 28 THR N -71.69 14.03 -13.35 -12.09 -15.99 . . 0 "[ . 1 .]" 70 . 1 26 TYR C 1 27 GLN N 1 27 GLN CA 1 27 GLN C -129.12 -37.66 -104.30 -104.61 -105.47 . . 0 "[ . 1 .]" 71 . 1 28 THR N 1 28 THR CA 1 28 THR C 1 29 LEU N 141.87 179.11 165.45 157.94 170.75 . . 0 "[ . 1 .]" 72 . 1 27 GLN C 1 28 THR N 1 28 THR CA 1 28 THR C -173.54 -83.86 -128.53 -133.87 -122.62 . . 0 "[ . 1 .]" 73 . 1 29 LEU N 1 29 LEU CA 1 29 LEU C 1 30 GLU N -46.87 -31.63 -27.47 -27.10 -27.30 6.56 13 3 "[ - . * 1 + .]" 74 . 1 28 THR C 1 29 LEU N 1 29 LEU CA 1 29 LEU C -70.37 -52.51 -67.26 -69.18 -64.83 . . 0 "[ . 1 .]" 75 . 1 30 GLU N 1 30 GLU CA 1 30 GLU C 1 31 ASP N -50.96 -35.62 -28.60 -33.50 -24.40 11.22 8 11 "[***-* +** ***]" 76 . 1 29 LEU C 1 30 GLU N 1 30 GLU CA 1 30 GLU C -74.96 -48.46 -68.17 -67.22 -68.23 . . 0 "[ . 1 .]" 77 . 1 31 ASP N 1 31 ASP CA 1 31 ASP C 1 32 PHE N -51.32 -28.50 -43.17 -45.00 -45.89 . . 0 "[ . 1 .]" 78 . 1 30 GLU C 1 31 ASP N 1 31 ASP CA 1 31 ASP C -81.11 -48.73 -83.96 -90.41 -78.63 9.30 10 5 "[ . * +-* *]" 79 . 1 32 PHE N 1 32 PHE CA 1 32 PHE C 1 33 LYS N -56.71 -25.55 -28.00 -28.99 -29.47 0.24 13 0 "[ . 1 .]" 80 . 1 31 ASP C 1 32 PHE N 1 32 PHE CA 1 32 PHE C -70.15 -58.77 -64.59 -64.91 -65.46 . . 0 "[ . 1 .]" 81 . 1 33 LYS N 1 33 LYS CA 1 33 LYS C 1 34 GLU N -55.75 -5.67 -8.08 -12.44 -4.27 1.40 8 0 "[ . 1 .]" 82 . 1 32 PHE C 1 33 LYS N 1 33 LYS CA 1 33 LYS C -92.33 -44.21 -67.97 -72.73 -65.43 . . 0 "[ . 1 .]" 83 . 1 34 GLU N 1 34 GLU CA 1 34 GLU C 1 35 LEU N -32.17 28.15 1.86 -1.26 -4.30 . . 0 "[ . 1 .]" 84 . 1 33 LYS C 1 34 GLU N 1 34 GLU CA 1 34 GLU C -116.50 -82.24 -103.19 -96.89 -100.02 . . 0 "[ . 1 .]" 85 . 1 35 LEU N 1 35 LEU CA 1 35 LEU C 1 36 ARG N 123.12 152.44 124.64 115.53 132.26 7.59 12 2 "[ . 1 + -.]" 86 . 1 34 GLU C 1 35 LEU N 1 35 LEU CA 1 35 LEU C -85.86 -53.46 -72.88 -75.48 -67.53 . . 0 "[ . 1 .]" 87 . 1 36 ARG N 1 36 ARG CA 1 36 ARG C 1 37 GLU N 145.73 -175.43 166.98 162.12 174.68 . . 0 "[ . 1 .]" 88 . 1 35 LEU C 1 36 ARG N 1 36 ARG CA 1 36 ARG C -149.37 -73.27 -125.95 -122.69 -124.59 . . 0 "[ . 1 .]" 89 . 1 37 GLU N 1 37 GLU CA 1 37 GLU C 1 38 THR N -53.66 -31.86 -41.38 -37.49 -39.09 . . 0 "[ . 1 .]" 90 . 1 36 ARG C 1 37 GLU N 1 37 GLU CA 1 37 GLU C -67.89 -44.53 -62.42 -67.98 -53.97 0.09 8 0 "[ . 1 .]" 91 . 1 38 THR N 1 38 THR CA 1 38 THR C 1 39 HIS N -58.55 -7.71 -27.88 -32.60 -23.62 . . 0 "[ . 1 .]" 92 . 1 37 GLU C 1 38 THR N 1 38 THR CA 1 38 THR C -73.88 -54.26 -59.03 -62.14 -56.44 . . 0 "[ . 1 .]" 93 . 1 39 HIS N 1 39 HIS CA 1 39 HIS C 1 40 LEU N -61.42 -25.94 -36.16 -36.80 -39.77 . . 0 "[ . 1 .]" 94 . 1 38 THR C 1 39 HIS N 1 39 HIS CA 1 39 HIS C -71.57 -57.29 -76.78 -77.89 -79.03 7.50 1 8 "[+**-. * * **]" 95 . 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 ASN N -53.94 -26.96 -33.12 -38.21 -26.64 0.32 15 0 "[ . 1 .]" 96 . 1 39 HIS C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -70.89 -53.43 -63.64 -71.07 -57.98 0.18 15 0 "[ . 1 .]" 97 . 1 41 ASN N 1 41 ASN CA 1 41 ASN C 1 42 GLU N -53.12 -22.18 -37.60 -36.79 -38.48 . . 0 "[ . 1 .]" 98 . 1 40 LEU C 1 41 ASN N 1 41 ASN CA 1 41 ASN C -75.48 -55.34 -58.50 -55.59 -56.49 0.11 11 0 "[ . 1 .]" 99 . 1 42 GLU N 1 42 GLU CA 1 42 GLU C 1 43 LEU N -49.60 -3.26 -36.83 -39.89 -41.06 . . 0 "[ . 1 .]" 100 . 1 41 ASN C 1 42 GLU N 1 42 GLU CA 1 42 GLU C -76.06 -53.82 -75.33 -79.59 -70.87 3.53 11 0 "[ . 1 .]" 101 . 1 43 LEU N 1 43 LEU CA 1 43 LEU C 1 44 ASN N -7.22 15.30 -3.96 -4.54 -5.58 1.56 7 0 "[ . 1 .]" 102 . 1 42 GLU C 1 43 LEU N 1 43 LEU CA 1 43 LEU C -107.61 -78.41 -78.16 -82.47 -73.68 4.73 1 0 "[ . 1 .]" 103 . 1 44 ASN N 1 44 ASN CA 1 44 ASN C 1 45 ILE N 15.64 58.48 24.93 14.56 32.29 1.08 10 0 "[ . 1 .]" 104 . 1 43 LEU C 1 44 ASN N 1 44 ASN CA 1 44 ASN C 29.83 97.71 68.03 68.77 67.77 . . 0 "[ . 1 .]" 105 . 1 45 ILE N 1 45 ILE CA 1 45 ILE C 1 46 MET N -62.39 56.27 79.58 72.59 87.70 31.43 6 15 [**-**+*********] 106 . 1 44 ASN C 1 45 ILE N 1 45 ILE CA 1 45 ILE C -146.82 -55.36 -91.02 -91.75 -93.32 . . 0 "[ . 1 .]" 107 . 1 47 ASP N 1 47 ASP CA 1 47 ASP C 1 48 PRO N 78.07 -176.77 106.27 104.95 102.92 . . 0 "[ . 1 .]" 108 . 1 46 MET C 1 47 ASP N 1 47 ASP CA 1 47 ASP C -142.91 -17.39 -61.22 -58.15 -58.87 . . 0 "[ . 1 .]" 109 . 1 48 PRO N 1 48 PRO CA 1 48 PRO C 1 49 GLN N -50.55 -20.01 -51.25 -52.08 -54.97 5.90 1 2 "[+ . 1 -.]" 110 . 1 47 ASP C 1 48 PRO N 1 48 PRO CA 1 48 PRO C -68.31 -38.33 -57.26 -61.97 -50.03 . . 0 "[ . 1 .]" 111 . 1 49 GLN N 1 49 GLN CA 1 49 GLN C 1 50 HIS N -55.00 -19.82 -36.17 -39.25 -32.14 . . 0 "[ . 1 .]" 112 . 1 48 PRO C 1 49 GLN N 1 49 GLN CA 1 49 GLN C -70.24 -60.84 -69.15 -70.14 -71.25 2.33 1 0 "[ . 1 .]" 113 . 1 50 HIS N 1 50 HIS CA 1 50 HIS C 1 51 ARG N -55.31 -34.31 -39.82 -40.01 -40.72 . . 0 "[ . 1 .]" 114 . 1 49 GLN C 1 50 HIS N 1 50 HIS CA 1 50 HIS C -70.71 -53.57 -66.65 -68.92 -64.34 . . 0 "[ . 1 .]" 115 . 1 51 ARG N 1 51 ARG CA 1 51 ARG C 1 52 ALA N -55.29 -30.57 -55.04 -55.62 -56.36 2.42 12 0 "[ . 1 .]" 116 . 1 50 HIS C 1 51 ARG N 1 51 ARG CA 1 51 ARG C -72.04 -49.90 -56.09 -57.87 -53.29 . . 0 "[ . 1 .]" 117 . 1 52 ALA N 1 52 ALA CA 1 52 ALA C 1 53 LYS N -57.71 -23.43 -42.64 -44.49 -40.75 . . 0 "[ . 1 .]" 118 . 1 51 ARG C 1 52 ALA N 1 52 ALA CA 1 52 ALA C -75.06 -47.84 -52.07 -50.45 -51.13 . . 0 "[ . 1 .]" 119 . 1 53 LYS N 1 53 LYS CA 1 53 LYS C 1 54 LEU N -55.34 -37.42 -51.89 -51.83 -52.72 . . 0 "[ . 1 .]" 120 . 1 52 ALA C 1 53 LYS N 1 53 LYS CA 1 53 LYS C -70.62 -52.86 -66.67 -68.71 -64.76 . . 0 "[ . 1 .]" 121 . 1 54 LEU N 1 54 LEU CA 1 54 LEU C 1 55 LEU N -58.42 -28.96 -45.08 -45.51 -45.69 . . 0 "[ . 1 .]" 122 . 1 53 LYS C 1 54 LEU N 1 54 LEU CA 1 54 LEU C -74.34 -49.04 -54.73 -56.00 -53.11 . . 0 "[ . 1 .]" 123 . 1 55 LEU N 1 55 LEU CA 1 55 LEU C 1 56 THR N -53.20 -20.08 -43.64 -36.71 -40.67 . . 0 "[ . 1 .]" 124 . 1 54 LEU C 1 55 LEU N 1 55 LEU CA 1 55 LEU C -71.45 -53.57 -64.60 -68.69 -61.11 . . 0 "[ . 1 .]" 125 . 1 56 THR N 1 56 THR CA 1 56 THR C 1 57 ALA N -50.96 -34.12 -40.47 -40.55 -40.82 . . 0 "[ . 1 .]" 126 . 1 55 LEU C 1 56 THR N 1 56 THR CA 1 56 THR C -71.44 -58.42 -62.79 -67.88 -59.90 . . 0 "[ . 1 .]" 127 . 1 57 ALA N 1 57 ALA CA 1 57 ALA C 1 58 ALA N -52.24 -34.34 -46.00 -48.72 -43.51 . . 0 "[ . 1 .]" 128 . 1 56 THR C 1 57 ALA N 1 57 ALA CA 1 57 ALA C -71.39 -54.95 -60.65 -62.43 -58.88 . . 0 "[ . 1 .]" 129 . 1 58 ALA N 1 58 ALA CA 1 58 ALA C 1 59 GLU N -54.90 -33.40 -41.41 -45.59 -38.28 . . 0 "[ . 1 .]" 130 . 1 57 ALA C 1 58 ALA N 1 58 ALA CA 1 58 ALA C -68.40 -52.38 -61.33 -60.17 -61.73 . . 0 "[ . 1 .]" 131 . 1 59 GLU N 1 59 GLU CA 1 59 GLU C 1 60 LEU N -54.01 -28.79 -53.03 -49.81 -52.66 1.35 11 0 "[ . 1 .]" 132 . 1 58 ALA C 1 59 GLU N 1 59 GLU CA 1 59 GLU C -76.10 -47.82 -57.89 -60.51 -56.31 . . 0 "[ . 1 .]" 133 . 1 60 LEU N 1 60 LEU CA 1 60 LEU C 1 61 LEU N -55.98 -24.66 -37.60 -35.36 -38.76 2.71 4 0 "[ . 1 .]" 134 . 1 59 GLU C 1 60 LEU N 1 60 LEU CA 1 60 LEU C -73.14 -50.14 -69.81 -74.09 -65.31 0.95 4 0 "[ . 1 .]" 135 . 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 LEU N -53.29 -17.71 -24.88 -29.51 -20.75 . . 0 "[ . 1 .]" 136 . 1 60 LEU C 1 61 LEU N 1 61 LEU CA 1 61 LEU C -84.24 -51.82 -64.78 -74.03 -56.77 . . 0 "[ . 1 .]" 137 . 1 62 LEU N 1 62 LEU CA 1 62 LEU C 1 63 ASP N -52.69 -9.43 -34.18 -43.67 -26.90 . . 0 "[ . 1 .]" 138 . 1 61 LEU C 1 62 LEU N 1 62 LEU CA 1 62 LEU C -73.88 -54.08 -70.53 -76.14 -56.04 2.26 13 0 "[ . 1 .]" 139 . 1 63 ASP N 1 63 ASP CA 1 63 ASP C 1 64 TYR N -61.17 19.45 -38.58 -37.64 -37.67 . . 0 "[ . 1 .]" 140 . 1 62 LEU C 1 63 ASP N 1 63 ASP CA 1 63 ASP C -103.78 -44.30 -104.02 -108.41 -110.02 9.63 3 3 "[* + . 1- .]" 141 . 1 64 TYR N 1 64 TYR CA 1 64 TYR C 1 65 ASP N -64.93 47.01 45.26 47.91 44.79 5.89 4 2 "[ - +. 1 .]" 142 . 1 63 ASP C 1 64 TYR N 1 64 TYR CA 1 64 TYR C -130.26 -58.02 -100.87 -99.69 -100.01 . . 0 "[ . 1 .]" stop_ save_
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