NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
384078 | 1k8h | cing | recoord | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_1k8h save_distance_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 591 _TA_constraint_stats_list.Viol_total 2527.21 _TA_constraint_stats_list.Viol_max 2.47 _TA_constraint_stats_list.Viol_rms 0.33 _TA_constraint_stats_list.Viol_average_all_restraints 0.18 _TA_constraint_stats_list.Viol_average_violations_only 0.43 _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 LYS O 1 6 ILE N 1 6 ILE CA 1 6 ILE O -145.00 -95.00 -110.13 -133.76 -94.85 0.15 6 0 "[ . 1]" 2 . 1 6 ILE N 1 6 ILE CA 1 6 ILE C 1 7 ILE N 125.00 175.00 139.10 124.90 168.11 0.10 6 0 "[ . 1]" 3 . 1 6 ILE O 1 7 ILE N 1 7 ILE CA 1 7 ILE O -145.00 -95.00 -133.60 -145.11 -114.12 0.11 3 0 "[ . 1]" 4 . 1 7 ILE N 1 7 ILE CA 1 7 ILE C 1 8 PRO N 125.00 175.00 124.96 124.85 124.74 0.70 8 0 "[ . 1]" 5 . 1 7 ILE O 1 8 PRO N 1 8 PRO CA 1 8 PRO O -145.00 -95.00 -101.00 -96.86 -98.57 0.26 6 0 "[ . 1]" 6 . 1 8 PRO N 1 8 PRO CA 1 8 PRO C 1 9 ILE N 125.00 175.00 141.68 143.80 142.30 . . 0 "[ . 1]" 7 . 1 8 PRO O 1 9 ILE N 1 9 ILE CA 1 9 ILE O -145.00 -95.00 -145.34 -145.36 -145.42 0.46 1 0 "[ . 1]" 8 . 1 9 ILE N 1 9 ILE CA 1 9 ILE C 1 10 ALA N 125.00 175.00 165.95 137.00 175.27 0.27 5 0 "[ . 1]" 9 . 1 13 LYS C 1 14 GLU N 1 14 GLU CA 1 14 GLU C -70.00 -50.00 -66.81 -70.51 -49.93 0.51 9 0 "[ . 1]" 10 . 1 14 GLU N 1 14 GLU CA 1 14 GLU C 1 15 ALA N -70.00 -50.00 -49.73 -49.90 -49.38 0.62 4 0 "[ . 1]" 11 . 1 14 GLU C 1 15 ALA N 1 15 ALA CA 1 15 ALA C -70.00 -50.00 -50.68 -54.03 -49.55 0.45 4 0 "[ . 1]" 12 . 1 15 ALA N 1 15 ALA CA 1 15 ALA C 1 16 LYS N -70.00 -50.00 -56.80 -65.46 -49.96 0.04 6 0 "[ . 1]" 13 . 1 15 ALA C 1 16 LYS N 1 16 LYS CA 1 16 LYS C -70.00 -50.00 -50.00 -54.22 -48.34 1.66 7 0 "[ . 1]" 14 . 1 16 LYS N 1 16 LYS CA 1 16 LYS C 1 17 ALA N -70.00 -50.00 -49.27 -49.73 -48.88 1.12 7 0 "[ . 1]" 15 . 1 16 LYS C 1 17 ALA N 1 17 ALA CA 1 17 ALA C -70.00 -50.00 -53.76 -50.05 -57.63 0.66 8 0 "[ . 1]" 16 . 1 17 ALA N 1 17 ALA CA 1 17 ALA C 1 18 LYS N -70.00 -50.00 -60.87 -62.15 -65.86 0.37 7 0 "[ . 1]" 17 . 1 19 TYR O 1 20 ASP N 1 20 ASP CA 1 20 ASP O -145.00 -95.00 -94.24 -94.98 -93.35 1.65 10 0 "[ . 1]" 18 . 1 20 ASP N 1 20 ASP CA 1 20 ASP C 1 21 ILE N 125.00 175.00 125.19 124.32 129.71 0.68 10 0 "[ . 1]" 19 . 1 20 ASP O 1 21 ILE N 1 21 ILE CA 1 21 ILE O -145.00 -95.00 -97.46 -109.70 -94.67 0.33 7 0 "[ . 1]" 20 . 1 21 ILE N 1 21 ILE CA 1 21 ILE C 1 22 LEU N 125.00 175.00 146.16 146.54 133.19 . . 0 "[ . 1]" 21 . 1 22 LEU O 1 23 GLU N 1 23 GLU CA 1 23 GLU O -145.00 -95.00 -130.05 -145.07 -109.64 0.07 9 0 "[ . 1]" 22 . 1 23 GLU N 1 23 GLU CA 1 23 GLU C 1 24 THR N 125.00 175.00 159.03 159.89 157.06 . . 0 "[ . 1]" 23 . 1 23 GLU O 1 24 THR N 1 24 THR CA 1 24 THR O -145.00 -95.00 -142.87 -145.45 -121.83 0.45 3 0 "[ . 1]" 24 . 1 24 THR N 1 24 THR CA 1 24 THR C 1 25 TYR N 125.00 175.00 161.77 155.85 143.39 . . 0 "[ . 1]" 25 . 1 24 THR O 1 25 TYR N 1 25 TYR CA 1 25 TYR O -145.00 -95.00 -135.48 -144.98 -119.57 . . 0 "[ . 1]" 26 . 1 25 TYR N 1 25 TYR CA 1 25 TYR C 1 26 GLU N 125.00 175.00 168.67 149.78 175.60 0.60 4 0 "[ . 1]" 27 . 1 25 TYR O 1 26 GLU N 1 26 GLU CA 1 26 GLU O -145.00 -95.00 -145.68 -146.06 -145.12 1.06 3 0 "[ . 1]" 28 . 1 26 GLU N 1 26 GLU CA 1 26 GLU C 1 27 ALA N 125.00 175.00 131.18 124.35 144.98 0.65 8 0 "[ . 1]" 29 . 1 26 GLU O 1 27 ALA N 1 27 ALA CA 1 27 ALA O -145.00 -95.00 -145.46 -145.89 -145.16 0.89 8 0 "[ . 1]" 30 . 1 27 ALA N 1 27 ALA CA 1 27 ALA C 1 28 GLY N 125.00 175.00 148.33 166.04 156.27 0.45 7 0 "[ . 1]" 31 . 1 27 ALA O 1 28 GLY N 1 28 GLY CA 1 28 GLY O -145.00 -95.00 -141.21 -145.15 -145.15 0.36 8 0 "[ . 1]" 32 . 1 28 GLY N 1 28 GLY CA 1 28 GLY C 1 29 ILE N 125.00 175.00 124.73 124.81 124.69 0.65 9 0 "[ . 1]" 33 . 1 28 GLY O 1 29 ILE N 1 29 ILE CA 1 29 ILE O -145.00 -95.00 -103.02 -105.06 -112.35 0.21 2 0 "[ . 1]" 34 . 1 29 ILE N 1 29 ILE CA 1 29 ILE C 1 30 VAL N 125.00 175.00 152.08 139.60 129.26 . . 0 "[ . 1]" 35 . 1 34 SER C 1 35 GLU N 1 35 GLU CA 1 35 GLU C -70.00 -50.00 -63.46 -70.11 -49.73 0.27 4 0 "[ . 1]" 36 . 1 35 GLU N 1 35 GLU CA 1 35 GLU C 1 36 VAL N -70.00 -50.00 -49.22 -49.84 -47.53 2.47 6 0 "[ . 1]" 37 . 1 35 GLU C 1 36 VAL N 1 36 VAL CA 1 36 VAL C -70.00 -50.00 -49.38 -49.96 -48.49 1.51 6 0 "[ . 1]" 38 . 1 36 VAL N 1 36 VAL CA 1 36 VAL C 1 37 LYS N -70.00 -50.00 -53.91 -59.57 -49.38 0.62 8 0 "[ . 1]" 39 . 1 36 VAL C 1 37 LYS N 1 37 LYS CA 1 37 LYS C -70.00 -50.00 -68.22 -71.03 -56.82 1.03 5 0 "[ . 1]" 40 . 1 37 LYS N 1 37 LYS CA 1 37 LYS C 1 38 SER N -70.00 -50.00 -49.80 -51.43 -49.42 0.58 1 0 "[ . 1]" 41 . 1 37 LYS C 1 38 SER N 1 38 SER CA 1 38 SER C -70.00 -50.00 -49.41 -49.61 -49.27 0.73 4 0 "[ . 1]" 42 . 1 38 SER N 1 38 SER CA 1 38 SER C 1 39 LEU N -70.00 -50.00 -52.94 -57.28 -50.47 . . 0 "[ . 1]" 43 . 1 38 SER C 1 39 LEU N 1 39 LEU CA 1 39 LEU C -70.00 -50.00 -68.76 -63.68 -68.74 0.59 4 0 "[ . 1]" 44 . 1 39 LEU N 1 39 LEU CA 1 39 LEU C 1 40 ARG N -70.00 -50.00 -48.92 -49.25 -48.18 1.82 5 0 "[ . 1]" 45 . 1 39 LEU C 1 40 ARG N 1 40 ARG CA 1 40 ARG C -70.00 -50.00 -49.35 -49.97 -48.96 1.04 5 0 "[ . 1]" 46 . 1 40 ARG N 1 40 ARG CA 1 40 ARG C 1 41 GLU N -70.00 -50.00 -50.65 -49.90 -54.20 0.70 10 0 "[ . 1]" 47 . 1 40 ARG C 1 41 GLU N 1 41 GLU CA 1 41 GLU C -70.00 -50.00 -58.51 -57.83 -61.50 0.27 4 0 "[ . 1]" 48 . 1 41 GLU N 1 41 GLU CA 1 41 GLU C 1 42 LYS N -70.00 -50.00 -61.40 -67.95 -49.82 0.18 1 0 "[ . 1]" 49 . 1 49 ASP O 1 50 SER N 1 50 SER CA 1 50 SER O -145.00 -95.00 -136.64 -128.25 -132.68 0.11 8 0 "[ . 1]" 50 . 1 50 SER N 1 50 SER CA 1 50 SER C 1 51 PHE N 125.00 175.00 128.11 124.78 138.76 0.22 4 0 "[ . 1]" 51 . 1 50 SER O 1 51 PHE N 1 51 PHE CA 1 51 PHE O -145.00 -95.00 -137.85 -145.25 -121.44 0.25 4 0 "[ . 1]" 52 . 1 51 PHE N 1 51 PHE CA 1 51 PHE C 1 52 VAL N 125.00 175.00 161.07 164.31 163.04 . . 0 "[ . 1]" 53 . 1 51 PHE O 1 52 VAL N 1 52 VAL CA 1 52 VAL O -145.00 -95.00 -144.24 -145.02 -145.04 0.17 8 0 "[ . 1]" 54 . 1 52 VAL N 1 52 VAL CA 1 52 VAL C 1 53 ARG N 125.00 175.00 130.48 132.34 132.20 0.08 9 0 "[ . 1]" 55 . 1 52 VAL O 1 53 ARG N 1 53 ARG CA 1 53 ARG O -145.00 -95.00 -145.24 -145.13 -145.26 0.35 8 0 "[ . 1]" 56 . 1 53 ARG N 1 53 ARG CA 1 53 ARG C 1 54 ILE N 125.00 175.00 132.78 124.73 142.01 0.27 10 0 "[ . 1]" 57 . 1 53 ARG O 1 54 ILE N 1 54 ILE CA 1 54 ILE O -145.00 -95.00 -113.71 -126.71 -101.53 . . 0 "[ . 1]" 58 . 1 54 ILE N 1 54 ILE CA 1 54 ILE C 1 55 GLU N 125.00 175.00 125.21 124.39 127.91 0.61 8 0 "[ . 1]" 59 . 1 54 ILE O 1 55 GLU N 1 55 GLU CA 1 55 GLU O -145.00 -95.00 -137.78 -145.77 -118.27 0.77 8 0 "[ . 1]" 60 . 1 55 GLU N 1 55 GLU CA 1 55 GLU C 1 56 ASN N 125.00 175.00 157.70 175.04 170.61 0.10 2 0 "[ . 1]" 61 . 1 57 GLY O 1 58 GLU N 1 58 GLU CA 1 58 GLU O -145.00 -95.00 -145.87 -146.72 -145.25 1.72 7 0 "[ . 1]" 62 . 1 58 GLU N 1 58 GLU CA 1 58 GLU C 1 59 ALA N 125.00 175.00 167.11 144.08 175.45 0.45 7 0 "[ . 1]" 63 . 1 58 GLU O 1 59 ALA N 1 59 ALA CA 1 59 ALA O -145.00 -95.00 -96.12 -99.41 -94.52 0.48 3 0 "[ . 1]" 64 . 1 59 ALA N 1 59 ALA CA 1 59 ALA C 1 60 TRP N 125.00 175.00 131.36 124.70 140.23 0.30 7 0 "[ . 1]" 65 . 1 59 ALA O 1 60 TRP N 1 60 TRP CA 1 60 TRP O -145.00 -95.00 -126.39 -138.57 -116.13 . . 0 "[ . 1]" 66 . 1 60 TRP N 1 60 TRP CA 1 60 TRP C 1 61 LEU N 125.00 175.00 144.25 136.03 151.68 . . 0 "[ . 1]" 67 . 1 60 TRP O 1 61 LEU N 1 61 LEU CA 1 61 LEU O -145.00 -95.00 -139.86 -145.16 -128.98 0.16 7 0 "[ . 1]" 68 . 1 61 LEU N 1 61 LEU CA 1 61 LEU C 1 62 TYR N 125.00 175.00 128.50 128.67 125.51 0.50 6 0 "[ . 1]" 69 . 1 61 LEU O 1 62 TYR N 1 62 TYR CA 1 62 TYR O -145.00 -95.00 -143.57 -145.08 -145.11 0.68 6 0 "[ . 1]" 70 . 1 62 TYR N 1 62 TYR CA 1 62 TYR C 1 63 ASN N 125.00 175.00 125.73 124.74 133.48 0.26 8 0 "[ . 1]" 71 . 1 62 TYR O 1 63 ASN N 1 63 ASN CA 1 63 ASN O -145.00 -95.00 -141.84 -145.18 -139.10 0.18 2 0 "[ . 1]" 72 . 1 63 ASN N 1 63 ASN CA 1 63 ASN C 1 64 LEU N 125.00 175.00 132.60 124.96 169.03 0.04 9 0 "[ . 1]" 73 . 1 82 LYS O 1 83 ARG N 1 83 ARG CA 1 83 ARG O -145.00 -95.00 -139.67 -137.85 -139.41 0.07 9 0 "[ . 1]" 74 . 1 83 ARG N 1 83 ARG CA 1 83 ARG C 1 84 LYS N 125.00 175.00 141.77 124.89 156.48 0.11 5 0 "[ . 1]" 75 . 1 83 ARG O 1 84 LYS N 1 84 LYS CA 1 84 LYS O -145.00 -95.00 -124.93 -132.90 -106.69 . . 0 "[ . 1]" 76 . 1 84 LYS N 1 84 LYS CA 1 84 LYS C 1 85 LEU N 125.00 175.00 128.36 124.92 124.86 0.21 6 0 "[ . 1]" 77 . 1 89 LYS C 1 90 ARG N 1 90 ARG CA 1 90 ARG C -70.00 -50.00 -67.21 -55.10 -70.17 0.80 5 0 "[ . 1]" 78 . 1 90 ARG N 1 90 ARG CA 1 90 ARG C 1 91 GLU N -70.00 -50.00 -49.74 -50.01 -48.97 1.03 7 0 "[ . 1]" 79 . 1 90 ARG C 1 91 GLU N 1 91 GLU CA 1 91 GLU C -70.00 -50.00 -53.02 -53.52 -56.42 0.38 9 0 "[ . 1]" 80 . 1 91 GLU N 1 91 GLU CA 1 91 GLU C 1 92 ILE N -70.00 -50.00 -52.32 -50.03 -52.27 1.61 7 0 "[ . 1]" 81 . 1 91 GLU C 1 92 ILE N 1 92 ILE CA 1 92 ILE C -70.00 -50.00 -51.46 -56.21 -47.91 2.09 7 0 "[ . 1]" 82 . 1 92 ILE N 1 92 ILE CA 1 92 ILE C 1 93 MET N -70.00 -50.00 -52.31 -62.61 -49.35 0.65 10 0 "[ . 1]" 83 . 1 92 ILE C 1 93 MET N 1 93 MET CA 1 93 MET C -70.00 -50.00 -53.42 -50.78 -53.99 0.28 10 0 "[ . 1]" 84 . 1 93 MET N 1 93 MET CA 1 93 MET C 1 94 ARG N -70.00 -50.00 -56.05 -67.09 -49.63 0.37 8 0 "[ . 1]" 85 . 1 93 MET C 1 94 ARG N 1 94 ARG CA 1 94 ARG C -70.00 -50.00 -54.34 -59.33 -49.93 0.07 9 0 "[ . 1]" 86 . 1 94 ARG N 1 94 ARG CA 1 94 ARG C 1 95 LEU N -70.00 -50.00 -53.26 -50.04 -53.38 0.86 4 0 "[ . 1]" 87 . 1 94 ARG C 1 95 LEU N 1 95 LEU CA 1 95 LEU C -70.00 -50.00 -51.92 -49.92 -50.48 0.62 4 0 "[ . 1]" 88 . 1 95 LEU N 1 95 LEU CA 1 95 LEU C 1 96 TYR N -70.00 -50.00 -55.23 -64.23 -49.06 0.94 1 0 "[ . 1]" 89 . 1 95 LEU C 1 96 TYR N 1 96 TYR CA 1 96 TYR C -70.00 -50.00 -51.82 -61.81 -49.82 0.18 1 0 "[ . 1]" 90 . 1 96 TYR N 1 96 TYR CA 1 96 TYR C 1 97 GLY N -70.00 -50.00 -57.42 -69.29 -49.64 0.36 1 0 "[ . 1]" 91 . 1 96 TYR C 1 97 GLY N 1 97 GLY CA 1 97 GLY C -70.00 -50.00 -56.42 -60.95 -64.65 0.05 6 0 "[ . 1]" 92 . 1 97 GLY N 1 97 GLY CA 1 97 GLY C 1 98 LYS N -70.00 -50.00 -65.20 -70.40 -50.06 0.40 2 0 "[ . 1]" 93 . 1 97 GLY C 1 98 LYS N 1 98 LYS CA 1 98 LYS C -70.00 -50.00 -55.98 -53.52 -53.53 0.11 4 0 "[ . 1]" 94 . 1 98 LYS N 1 98 LYS CA 1 98 LYS C 1 99 VAL N -70.00 -50.00 -62.55 -69.75 -57.56 . . 0 "[ . 1]" 95 . 1 98 LYS C 1 99 VAL N 1 99 VAL CA 1 99 VAL C -70.00 -50.00 -50.37 -53.52 -49.51 0.49 1 0 "[ . 1]" 96 . 1 99 VAL N 1 99 VAL CA 1 99 VAL C 1 100 GLN N -70.00 -50.00 -62.26 -70.88 -49.72 0.88 9 0 "[ . 1]" 97 . 1 99 VAL C 1 100 GLN N 1 100 GLN CA 1 100 GLN C -70.00 -50.00 -61.69 -59.57 -69.09 0.43 3 0 "[ . 1]" 98 . 1 100 GLN N 1 100 GLN CA 1 100 GLN C 1 101 GLU N -70.00 -50.00 -61.73 -70.00 -49.84 0.16 3 0 "[ . 1]" 99 . 1 100 GLN C 1 101 GLU N 1 101 GLU CA 1 101 GLU C -70.00 -50.00 -58.32 -50.03 -58.08 0.35 6 0 "[ . 1]" 100 . 1 101 GLU N 1 101 GLU CA 1 101 GLU C 1 102 LYS N -70.00 -50.00 -58.51 -62.67 -50.80 . . 0 "[ . 1]" 101 . 1 101 GLU C 1 102 LYS N 1 102 LYS CA 1 102 LYS C -70.00 -50.00 -48.96 -49.22 -48.66 1.34 4 0 "[ . 1]" 102 . 1 102 LYS N 1 102 LYS CA 1 102 LYS C 1 103 GLY N -70.00 -50.00 -49.56 -49.64 -49.65 0.65 4 0 "[ . 1]" 103 . 1 103 GLY O 1 104 TYR N 1 104 TYR CA 1 104 TYR O -145.00 -95.00 -139.07 -145.15 -132.43 0.15 6 0 "[ . 1]" 104 . 1 104 TYR N 1 104 TYR CA 1 104 TYR C 1 105 THR N 125.00 175.00 165.68 161.33 171.63 . . 0 "[ . 1]" 105 . 1 104 TYR O 1 105 THR N 1 105 THR CA 1 105 THR O -145.00 -95.00 -142.15 -141.83 -142.14 0.43 9 0 "[ . 1]" 106 . 1 105 THR N 1 105 THR CA 1 105 THR C 1 106 ILE N 125.00 175.00 158.50 166.10 163.20 . . 0 "[ . 1]" 107 . 1 105 THR O 1 106 ILE N 1 106 ILE CA 1 106 ILE O -145.00 -95.00 -140.22 -145.23 -131.93 0.23 3 0 "[ . 1]" 108 . 1 106 ILE N 1 106 ILE CA 1 106 ILE C 1 107 ILE N 125.00 175.00 131.62 133.39 132.21 . . 0 "[ . 1]" 109 . 1 106 ILE O 1 107 ILE N 1 107 ILE CA 1 107 ILE O -145.00 -95.00 -145.21 -145.55 -145.07 0.55 3 0 "[ . 1]" 110 . 1 107 ILE N 1 107 ILE CA 1 107 ILE C 1 108 PRO N 125.00 175.00 151.40 139.52 157.43 . . 0 "[ . 1]" 111 . 1 107 ILE O 1 108 PRO N 1 108 PRO CA 1 108 PRO O -145.00 -95.00 -95.53 -94.73 -94.81 0.39 3 0 "[ . 1]" 112 . 1 108 PRO N 1 108 PRO CA 1 108 PRO C 1 109 LEU N 125.00 175.00 150.77 133.37 165.91 . . 0 "[ . 1]" 113 . 1 109 LEU O 1 110 LYS N 1 110 LYS CA 1 110 LYS O -145.00 -95.00 -145.89 -145.82 -145.92 1.41 10 0 "[ . 1]" 114 . 1 110 LYS N 1 110 LYS CA 1 110 LYS C 1 111 LEU N 125.00 175.00 127.64 126.35 124.99 0.53 7 0 "[ . 1]" 115 . 1 110 LYS O 1 111 LEU N 1 111 LEU CA 1 111 LEU O -145.00 -95.00 -145.83 -145.88 -145.98 1.51 4 0 "[ . 1]" 116 . 1 111 LEU N 1 111 LEU CA 1 111 LEU C 1 112 TYR N 125.00 175.00 124.44 126.96 124.78 1.77 10 0 "[ . 1]" 117 . 1 111 LEU O 1 112 TYR N 1 112 TYR CA 1 112 TYR O -145.00 -95.00 -145.17 -146.93 -138.83 1.93 4 0 "[ . 1]" 118 . 1 112 TYR N 1 112 TYR CA 1 112 TYR C 1 113 TRP N 125.00 175.00 151.52 143.33 156.64 . . 0 "[ . 1]" 119 . 1 112 TYR O 1 113 TRP N 1 113 TRP CA 1 113 TRP O -145.00 -95.00 -130.93 -129.79 -131.89 . . 0 "[ . 1]" 120 . 1 113 TRP N 1 113 TRP CA 1 113 TRP C 1 114 LYS N 125.00 175.00 123.91 124.43 124.10 1.52 4 0 "[ . 1]" 121 . 1 113 TRP O 1 114 LYS N 1 114 LYS CA 1 114 LYS O -145.00 -95.00 -125.98 -129.09 -122.84 . . 0 "[ . 1]" 122 . 1 114 LYS N 1 114 LYS CA 1 114 LYS C 1 115 ASN N 125.00 175.00 147.69 151.61 150.04 . . 0 "[ . 1]" 123 . 1 116 ASN O 1 117 LYS N 1 117 LYS CA 1 117 LYS O -145.00 -95.00 -143.89 -141.64 -144.96 0.27 6 0 "[ . 1]" 124 . 1 117 LYS N 1 117 LYS CA 1 117 LYS C 1 118 VAL N 125.00 175.00 161.78 166.63 163.87 . . 0 "[ . 1]" 125 . 1 117 LYS O 1 118 VAL N 1 118 VAL CA 1 118 VAL O -145.00 -95.00 -107.09 -109.24 -110.68 . . 0 "[ . 1]" 126 . 1 118 VAL N 1 118 VAL CA 1 118 VAL C 1 119 LYS N 125.00 175.00 145.25 136.01 153.18 . . 0 "[ . 1]" 127 . 1 118 VAL O 1 119 LYS N 1 119 LYS CA 1 119 LYS O -145.00 -95.00 -146.09 -146.11 -146.23 1.53 6 0 "[ . 1]" 128 . 1 119 LYS N 1 119 LYS CA 1 119 LYS C 1 120 VAL N 125.00 175.00 124.28 124.47 124.41 1.08 5 0 "[ . 1]" 129 . 1 119 LYS O 1 120 VAL N 1 120 VAL CA 1 120 VAL O -145.00 -95.00 -128.19 -124.21 -125.61 . . 0 "[ . 1]" 130 . 1 120 VAL N 1 120 VAL CA 1 120 VAL C 1 121 LEU N 125.00 175.00 131.83 139.53 135.94 0.13 8 0 "[ . 1]" 131 . 1 120 VAL O 1 121 LEU N 1 121 LEU CA 1 121 LEU O -145.00 -95.00 -122.81 -132.07 -116.92 . . 0 "[ . 1]" 132 . 1 121 LEU N 1 121 LEU CA 1 121 LEU C 1 122 ILE N 125.00 175.00 124.73 124.36 124.98 0.64 7 0 "[ . 1]" 133 . 1 121 LEU O 1 122 ILE N 1 122 ILE CA 1 122 ILE O -145.00 -95.00 -131.28 -142.77 -126.08 . . 0 "[ . 1]" 134 . 1 122 ILE N 1 122 ILE CA 1 122 ILE C 1 123 ALA N 125.00 175.00 140.50 124.83 153.53 0.17 6 0 "[ . 1]" 135 . 1 122 ILE O 1 123 ALA N 1 123 ALA CA 1 123 ALA O -145.00 -95.00 -135.19 -141.54 -144.92 0.10 1 0 "[ . 1]" 136 . 1 123 ALA N 1 123 ALA CA 1 123 ALA C 1 124 LEU N 125.00 175.00 136.42 124.97 158.77 0.03 6 0 "[ . 1]" 137 . 1 123 ALA O 1 124 LEU N 1 124 LEU CA 1 124 LEU O -145.00 -95.00 -119.33 -114.87 -118.72 . . 0 "[ . 1]" 138 . 1 124 LEU N 1 124 LEU CA 1 124 LEU C 1 125 ALA N 125.00 175.00 126.49 124.72 132.24 0.28 7 0 "[ . 1]" 139 . 1 124 LEU O 1 125 ALA N 1 125 ALA CA 1 125 ALA O -145.00 -95.00 -130.86 -125.43 -131.35 . . 0 "[ . 1]" 140 . 1 125 ALA N 1 125 ALA CA 1 125 ALA C 1 126 LYS N 125.00 175.00 160.67 158.73 152.52 . . 0 "[ . 1]" 141 . 1 125 ALA O 1 126 LYS N 1 126 LYS CA 1 126 LYS O -145.00 -95.00 -122.12 -145.07 -102.81 0.07 7 0 "[ . 1]" 142 . 1 126 LYS N 1 126 LYS CA 1 126 LYS C 1 127 GLY N 125.00 175.00 151.89 134.02 175.01 0.01 10 0 "[ . 1]" stop_ save_
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