NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
544662 | 2lq7 | 18297 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2lq7 save_dihedral_constraint_statistics_1 _TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics _TA_constraint_stats_list.Constraint_count 156 _TA_constraint_stats_list.Viol_count 1766 _TA_constraint_stats_list.Viol_total 47656.61 _TA_constraint_stats_list.Viol_max 10.74 _TA_constraint_stats_list.Viol_rms 1.17 _TA_constraint_stats_list.Viol_average_all_restraints 0.76 _TA_constraint_stats_list.Viol_average_violations_only 1.35 _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 PHI 1 1 GLY C 1 2 SER N 1 2 SER CA 1 2 SER C -129.00 -103.00 -117.40 -106.97 -108.92 1.27 11 0 "[ . 1 . 2]" 2 PSI 1 2 SER N 1 2 SER CA 1 2 SER C 1 3 GLN N 133.00 153.00 137.52 137.17 135.41 1.43 18 0 "[ . 1 . 2]" 3 PHI 1 2 SER C 1 3 GLN N 1 3 GLN CA 1 3 GLN C -115.00 -95.00 -98.62 -115.42 -93.35 1.65 14 0 "[ . 1 . 2]" 4 PSI 1 3 GLN N 1 3 GLN CA 1 3 GLN C 1 4 LEU N -14.00 18.00 -12.31 -18.75 1.21 4.75 11 0 "[ . 1 . 2]" 5 PHI 1 3 GLN C 1 4 LEU N 1 4 LEU CA 1 4 LEU C -88.00 -72.00 -84.47 -84.32 -86.63 2.75 6 0 "[ . 1 . 2]" 6 PSI 1 4 LEU N 1 4 LEU CA 1 4 LEU C 1 5 PRO N 136.00 148.00 142.41 146.66 142.00 1.27 16 0 "[ . 1 . 2]" 7 PSI 1 5 PRO N 1 5 PRO CA 1 5 PRO C 1 6 GLN N 140.00 152.00 139.43 135.78 145.68 4.22 4 0 "[ . 1 . 2]" 8 PHI 1 5 PRO C 1 6 GLN N 1 6 GLN CA 1 6 GLN C -105.00 -79.00 -94.89 -106.01 -79.03 1.01 7 0 "[ . 1 . 2]" 9 PSI 1 6 GLN N 1 6 GLN CA 1 6 GLN C 1 7 ASN N 117.00 139.00 139.33 129.93 143.11 4.11 10 0 "[ . 1 . 2]" 10 PHI 1 6 GLN C 1 7 ASN N 1 7 ASN CA 1 7 ASN C -141.00 -105.00 -103.79 -107.65 -101.48 3.52 15 0 "[ . 1 . 2]" 11 PSI 1 7 ASN N 1 7 ASN CA 1 7 ASN C 1 8 ILE N 138.00 154.00 137.55 135.71 141.74 2.29 4 0 "[ . 1 . 2]" 12 PHI 1 7 ASN C 1 8 ILE N 1 8 ILE CA 1 8 ILE C -143.00 -117.00 -136.77 -143.33 -129.59 0.33 4 0 "[ . 1 . 2]" 13 PSI 1 8 ILE N 1 8 ILE CA 1 8 ILE C 1 9 GLN N 136.00 156.00 142.66 135.12 156.23 0.88 9 0 "[ . 1 . 2]" 14 PHI 1 8 ILE C 1 9 GLN N 1 9 GLN CA 1 9 GLN C -132.00 114.00 -115.05 -129.11 -94.59 . . 0 "[ . 1 . 2]" 15 PSI 1 9 GLN N 1 9 GLN CA 1 9 GLN C 1 10 PHE N 135.00 147.00 132.86 130.69 135.06 4.31 5 0 "[ . 1 . 2]" 16 PHI 1 9 GLN C 1 10 PHE N 1 10 PHE CA 1 10 PHE C -137.00 -122.00 -138.57 -140.28 -135.45 3.28 5 0 "[ . 1 . 2]" 17 PSI 1 10 PHE N 1 10 PHE CA 1 10 PHE C 1 11 SER N 141.00 153.00 155.94 153.10 157.15 4.15 3 0 "[ . 1 . 2]" 18 PHI 1 10 PHE C 1 11 SER N 1 11 SER CA 1 11 SER C -108.00 -92.00 -90.31 -90.92 -90.98 3.79 13 0 "[ . 1 . 2]" 19 PSI 1 11 SER N 1 11 SER CA 1 11 SER C 1 12 PRO N 120.00 134.00 136.01 135.75 135.29 3.00 20 0 "[ . 1 . 2]" 20 PSI 1 12 PRO N 1 12 PRO CA 1 12 PRO C 1 13 SER N -35.00 -15.00 -23.34 -14.94 -19.76 0.41 6 0 "[ . 1 . 2]" 21 PHI 1 12 PRO C 1 13 SER N 1 13 SER CA 1 13 SER C -102.00 -86.00 -85.80 -86.05 -86.21 1.40 6 0 "[ . 1 . 2]" 22 PSI 1 13 SER N 1 13 SER CA 1 13 SER C 1 14 ALA N -9.00 1.00 -1.95 -1.13 -1.31 1.20 8 0 "[ . 1 . 2]" 23 PHI 1 13 SER C 1 14 ALA N 1 14 ALA CA 1 14 ALA C -76.00 -65.00 -76.16 -76.34 -76.42 1.45 17 0 "[ . 1 . 2]" 24 PSI 1 14 ALA N 1 14 ALA CA 1 14 ALA C 1 15 LYS N 145.00 156.00 144.84 143.79 149.92 1.21 16 0 "[ . 1 . 2]" 25 PHI 1 14 ALA C 1 15 LYS N 1 15 LYS CA 1 15 LYS C -107.00 -81.00 -91.88 -89.48 -89.48 . . 0 "[ . 1 . 2]" 26 PSI 1 15 LYS N 1 15 LYS CA 1 15 LYS C 1 16 LEU N 147.00 163.00 156.25 145.39 164.40 1.61 5 0 "[ . 1 . 2]" 27 PHI 1 15 LYS C 1 16 LEU N 1 16 LEU CA 1 16 LEU C -63.00 -57.00 -61.08 -61.66 -62.37 0.61 10 0 "[ . 1 . 2]" 28 PSI 1 16 LEU N 1 16 LEU CA 1 16 LEU C 1 17 GLN N -47.00 -31.00 -38.98 -47.56 -30.29 0.71 8 0 "[ . 1 . 2]" 29 PHI 1 16 LEU C 1 17 GLN N 1 17 GLN CA 1 17 GLN C -70.00 -58.00 -60.23 -58.16 -59.18 0.42 13 0 "[ . 1 . 2]" 30 PSI 1 17 GLN N 1 17 GLN CA 1 17 GLN C 1 18 GLU N -46.00 -40.00 -39.14 -41.89 -37.21 2.79 12 0 "[ . 1 . 2]" 31 PHI 1 17 GLN C 1 18 GLU N 1 18 GLU CA 1 18 GLU C -68.00 -64.00 -63.83 -64.24 -65.80 1.69 19 0 "[ . 1 . 2]" 32 PSI 1 18 GLU N 1 18 GLU CA 1 18 GLU C 1 19 VAL N -41.00 -35.00 -34.58 -32.65 -33.02 2.47 7 0 "[ . 1 . 2]" 33 PHI 1 18 GLU C 1 19 VAL N 1 19 VAL CA 1 19 VAL C -69.00 -61.00 -62.66 -69.38 -60.40 0.60 1 0 "[ . 1 . 2]" 34 PSI 1 19 VAL N 1 19 VAL CA 1 19 VAL C 1 20 LEU N -44.00 -38.00 -40.72 -44.67 -37.13 0.87 17 0 "[ . 1 . 2]" 35 PHI 1 19 VAL C 1 20 LEU N 1 20 LEU CA 1 20 LEU C -71.00 -63.00 -65.69 -71.06 -61.87 1.13 20 0 "[ . 1 . 2]" 36 PSI 1 20 LEU N 1 20 LEU CA 1 20 LEU C 1 21 ASP N -44.00 -30.00 -42.96 -36.30 -39.19 2.53 5 0 "[ . 1 . 2]" 37 PHI 1 20 LEU C 1 21 ASP N 1 21 ASP CA 1 21 ASP C -65.00 -59.00 -62.41 -62.70 -63.16 2.06 17 0 "[ . 1 . 2]" 38 PSI 1 21 ASP N 1 21 ASP CA 1 21 ASP C 1 22 TYR N -46.00 -39.00 -41.59 -47.64 -35.67 3.33 3 0 "[ . 1 . 2]" 39 PHI 1 21 ASP C 1 22 TYR N 1 22 TYR CA 1 22 TYR C -70.00 -56.00 -70.49 -73.27 -64.52 3.27 4 0 "[ . 1 . 2]" 40 PSI 1 22 TYR N 1 22 TYR CA 1 22 TYR C 1 23 LEU N -80.00 -24.00 -28.68 -33.65 -36.99 2.18 9 0 "[ . 1 . 2]" 41 PHI 1 22 TYR C 1 23 LEU N 1 23 LEU CA 1 23 LEU C -80.00 -56.00 -59.05 -55.90 -56.82 2.73 9 0 "[ . 1 . 2]" 42 PSI 1 23 LEU N 1 23 LEU CA 1 23 LEU C 1 24 THR N -64.00 -10.00 -67.59 -71.55 -66.22 7.55 8 4 "[ . + 1 * .- *2]" 43 PHI 1 23 LEU C 1 24 THR N 1 24 THR CA 1 24 THR C -115.00 -58.00 -119.79 -125.74 -117.63 10.74 8 5 "[ . + 1 * .- **]" 44 PSI 1 24 THR N 1 24 THR CA 1 24 THR C 1 25 ASN N -70.00 8.00 -72.16 -76.01 -67.12 6.01 13 2 "[ . - 1 + . 2]" 45 PHI 1 24 THR C 1 25 ASN N 1 25 ASN CA 1 25 ASN C -125.00 -60.00 -128.62 -133.86 -125.97 8.86 13 5 "[ .* * 1 + . *-]" 46 PSI 1 25 ASN N 1 25 ASN CA 1 25 ASN C 1 26 SER N 120.00 150.00 146.31 149.03 147.48 2.60 8 0 "[ . 1 . 2]" 47 PHI 1 25 ASN C 1 26 SER N 1 26 SER CA 1 26 SER C -82.00 -49.00 -83.71 -82.59 -83.41 2.65 13 0 "[ . 1 . 2]" 48 PSI 1 26 SER N 1 26 SER CA 1 26 SER C 1 27 ALA N -57.00 -16.00 -57.95 -57.08 -57.64 3.68 1 0 "[ . 1 . 2]" 49 PHI 1 26 SER C 1 27 ALA N 1 27 ALA CA 1 27 ALA C -95.00 -37.00 -90.73 -96.33 -79.35 1.33 10 0 "[ . 1 . 2]" 50 PSI 1 27 ALA N 1 27 ALA CA 1 27 ALA C 1 28 SER N -37.00 -7.00 -36.57 -37.50 -37.55 4.93 10 0 "[ . 1 . 2]" 51 PHI 1 27 ALA C 1 28 SER N 1 28 SER CA 1 28 SER C -84.00 -71.00 -79.34 -77.94 -78.91 3.82 10 0 "[ . 1 . 2]" 52 PSI 1 28 SER N 1 28 SER CA 1 28 SER C 1 29 LEU N -28.00 -6.00 -19.35 -15.62 -15.74 2.37 10 0 "[ . 1 . 2]" 53 PHI 1 28 SER C 1 29 LEU N 1 29 LEU CA 1 29 LEU C -96.00 -74.00 -97.63 -98.58 -98.89 3.50 9 0 "[ . 1 . 2]" 54 PSI 1 29 LEU N 1 29 LEU CA 1 29 LEU C 1 30 GLN N -15.00 10.00 4.36 -6.11 12.51 2.51 20 0 "[ . 1 . 2]" 55 PHI 1 29 LEU C 1 30 GLN N 1 30 GLN CA 1 30 GLN C -80.00 -60.00 -60.37 -65.25 -57.80 2.20 1 0 "[ . 1 . 2]" 56 PSI 1 30 GLN N 1 30 GLN CA 1 30 GLN C 1 31 MET N -35.00 -8.00 -33.39 -36.98 -37.78 4.14 11 0 "[ . 1 . 2]" 57 PHI 1 30 GLN C 1 31 MET N 1 31 MET CA 1 31 MET C -108.00 -56.00 -103.22 -106.20 -107.71 2.70 1 0 "[ . 1 . 2]" 58 PSI 1 31 MET N 1 31 MET CA 1 31 MET C 1 32 LYS N -30.00 -10.00 -24.99 -31.37 -12.07 1.37 10 0 "[ . 1 . 2]" 59 PHI 1 31 MET C 1 32 LYS N 1 32 LYS CA 1 32 LYS C -82.00 -70.00 -82.48 -82.69 -82.85 2.97 9 0 "[ . 1 . 2]" 60 PSI 1 32 LYS N 1 32 LYS CA 1 32 LYS C 1 33 SER N -43.00 -2.00 2.22 -2.42 5.86 7.86 17 4 "[* . 1 .-+* 2]" 61 PHI 1 32 LYS C 1 33 SER N 1 33 SER CA 1 33 SER C -134.00 -75.00 -70.48 -73.85 -66.39 8.61 17 6 "[* .-* 1 .*+* 2]" 62 PSI 1 33 SER N 1 33 SER CA 1 33 SER C 1 34 PRO N 141.00 167.00 141.12 140.07 139.82 2.93 6 0 "[ . 1 . 2]" 63 PSI 1 34 PRO N 1 34 PRO CA 1 34 PRO C 1 35 ALA N 135.00 157.00 159.45 151.09 162.74 5.74 12 2 "[ . 1 + .- 2]" 64 PHI 1 34 PRO C 1 35 ALA N 1 35 ALA CA 1 35 ALA C -135.00 -115.00 -111.72 -109.81 -110.53 6.07 15 3 "[ - . 1 * + 2]" 65 PSI 1 35 ALA N 1 35 ALA CA 1 35 ALA C 1 36 ILE N 133.00 149.00 134.26 132.89 132.33 1.77 18 0 "[ . 1 . 2]" 66 PHI 1 35 ALA C 1 36 ILE N 1 36 ILE CA 1 36 ILE C -125.00 -111.00 -111.78 -109.03 -109.05 3.90 10 0 "[ . 1 . 2]" 67 PSI 1 36 ILE N 1 36 ILE CA 1 36 ILE C 1 37 THR N 124.00 138.00 128.18 122.77 137.37 1.23 8 0 "[ . 1 . 2]" 68 PHI 1 36 ILE C 1 37 THR N 1 37 THR CA 1 37 THR C -138.00 -126.00 -130.20 -138.24 -123.44 2.56 9 0 "[ . 1 . 2]" 69 PSI 1 37 THR N 1 37 THR CA 1 37 THR C 1 38 ALA N 140.00 158.00 141.33 142.05 140.36 1.94 1 0 "[ . 1 . 2]" 70 PHI 1 37 THR C 1 38 ALA N 1 38 ALA CA 1 38 ALA C -144.00 -126.00 -127.49 -125.83 -128.47 2.09 10 0 "[ . 1 . 2]" 71 PSI 1 38 ALA N 1 38 ALA CA 1 38 ALA C 1 39 THR N 138.00 148.00 144.66 136.96 151.47 3.47 5 0 "[ . 1 . 2]" 72 PHI 1 38 ALA C 1 39 THR N 1 39 THR CA 1 39 THR C -118.00 -101.00 -101.42 -114.52 -96.62 4.38 20 0 "[ . 1 . 2]" 73 PSI 1 39 THR N 1 39 THR CA 1 39 THR C 1 40 LEU N 122.00 130.00 123.11 119.09 130.60 2.91 11 0 "[ . 1 . 2]" 74 PHI 1 39 THR C 1 40 LEU N 1 40 LEU CA 1 40 LEU C -133.00 -113.00 -130.01 -125.96 -126.95 1.62 11 0 "[ . 1 . 2]" 75 PSI 1 40 LEU N 1 40 LEU CA 1 40 LEU C 1 41 GLU N 117.00 131.00 121.12 116.95 116.73 1.23 20 0 "[ . 1 . 2]" 76 PHI 1 40 LEU C 1 41 GLU N 1 41 GLU CA 1 41 GLU C 49.00 55.00 55.83 56.23 55.91 2.08 11 0 "[ . 1 . 2]" 77 PSI 1 41 GLU N 1 41 GLU CA 1 41 GLU C 1 42 GLY N 38.00 44.00 36.42 37.86 37.76 3.14 6 0 "[ . 1 . 2]" 78 PHI 1 41 GLU C 1 42 GLY N 1 42 GLY CA 1 42 GLY C 72.00 82.00 80.47 73.43 83.49 1.49 8 0 "[ . 1 . 2]" 79 PSI 1 42 GLY N 1 42 GLY CA 1 42 GLY C 1 43 LYS N -4.00 9.00 -0.33 -4.50 7.48 0.50 19 0 "[ . 1 . 2]" 80 PHI 1 42 GLY C 1 43 LYS N 1 43 LYS CA 1 43 LYS C -118.00 -102.00 -107.59 -112.62 -116.53 1.22 2 0 "[ . 1 . 2]" 81 PSI 1 43 LYS N 1 43 LYS CA 1 43 LYS C 1 44 ASN N 137.00 147.00 143.28 134.85 149.69 2.69 11 0 "[ . 1 . 2]" 82 PHI 1 43 LYS C 1 44 ASN N 1 44 ASN CA 1 44 ASN C -104.00 -90.00 -90.79 -104.09 -87.56 2.44 10 0 "[ . 1 . 2]" 83 PSI 1 44 ASN N 1 44 ASN CA 1 44 ASN C 1 45 ARG N 122.00 132.00 121.74 120.56 119.99 4.90 9 0 "[ . 1 . 2]" 84 PHI 1 44 ASN C 1 45 ARG N 1 45 ARG CA 1 45 ARG C -108.00 -92.00 -107.98 -108.99 -109.48 4.21 9 0 "[ . 1 . 2]" 85 PSI 1 45 ARG N 1 45 ARG CA 1 45 ARG C 1 46 THR N 123.00 129.00 123.85 118.84 132.81 4.16 3 0 "[ . 1 . 2]" 86 PHI 1 45 ARG C 1 46 THR N 1 46 THR CA 1 46 THR C -96.00 -80.00 -85.26 -81.79 -83.75 3.01 11 0 "[ . 1 . 2]" 87 PSI 1 46 THR N 1 46 THR CA 1 46 THR C 1 47 LEU N 121.00 133.00 122.37 118.43 133.57 2.57 9 0 "[ . 1 . 2]" 88 PHI 1 46 THR C 1 47 LEU N 1 47 LEU CA 1 47 LEU C -107.00 -87.00 -97.33 -87.13 -91.85 3.00 6 0 "[ . 1 . 2]" 89 PSI 1 47 LEU N 1 47 LEU CA 1 47 LEU C 1 48 TYR N -39.00 -27.00 -32.68 -40.55 -25.51 1.55 4 0 "[ . 1 . 2]" 90 PSI 1 61 PRO N 1 61 PRO CA 1 61 PRO C 1 62 ASN N -36.00 -30.00 -34.23 -30.90 -35.14 3.84 8 0 "[ . 1 . 2]" 91 PHI 1 61 PRO C 1 62 ASN N 1 62 ASN CA 1 62 ASN C -71.00 -60.00 -64.67 -61.06 -62.58 3.57 8 0 "[ . 1 . 2]" 92 PSI 1 62 ASN N 1 62 ASN CA 1 62 ASN C 1 63 LEU N -45.00 -35.00 -38.67 -39.67 -40.05 2.03 15 0 "[ . 1 . 2]" 93 PHI 1 62 ASN C 1 63 LEU N 1 63 LEU CA 1 63 LEU C -70.00 -63.00 -69.60 -70.93 -71.76 1.91 12 0 "[ . 1 . 2]" 94 PSI 1 63 LEU N 1 63 LEU CA 1 63 LEU C 1 64 SER N -33.00 -25.00 -28.61 -24.74 -29.52 1.87 20 0 "[ . 1 . 2]" 95 PHI 1 63 LEU C 1 64 SER N 1 64 SER CA 1 64 SER C -92.00 -76.00 -87.69 -93.57 -75.84 1.57 8 0 "[ . 1 . 2]" 96 PSI 1 64 SER N 1 64 SER CA 1 64 SER C 1 65 LYS N -32.00 -8.00 -15.87 -17.19 -20.85 0.11 20 0 "[ . 1 . 2]" 97 PHI 1 64 SER C 1 65 LYS N 1 65 LYS CA 1 65 LYS C -97.00 -71.00 -91.11 -98.10 -78.32 1.10 3 0 "[ . 1 . 2]" 98 PSI 1 65 LYS N 1 65 LYS CA 1 65 LYS C 1 66 THR N 148.00 160.00 159.95 159.71 159.12 1.49 5 0 "[ . 1 . 2]" 99 PHI 1 65 LYS C 1 66 THR N 1 66 THR CA 1 66 THR C -102.00 -84.00 -85.69 -90.62 -82.73 1.27 9 0 "[ . 1 . 2]" 100 PSI 1 66 THR N 1 66 THR CA 1 66 THR C 1 67 LEU N 166.00 174.00 164.90 167.46 166.21 4.21 20 0 "[ . 1 . 2]" 101 PHI 1 66 THR C 1 67 LEU N 1 67 LEU CA 1 67 LEU C -61.00 -55.00 -59.92 -57.09 -58.27 1.76 20 0 "[ . 1 . 2]" 102 PSI 1 67 LEU N 1 67 LEU CA 1 67 LEU C 1 68 LYS N -42.00 -36.00 -36.98 -35.19 -35.49 1.30 4 0 "[ . 1 . 2]" 103 PHI 1 67 LEU C 1 68 LYS N 1 68 LYS CA 1 68 LYS C -67.00 -61.00 -64.99 -63.92 -64.85 1.02 5 0 "[ . 1 . 2]" 104 PSI 1 68 LYS N 1 68 LYS CA 1 68 LYS C 1 69 GLU N -45.00 -39.00 -44.07 -42.70 -43.75 2.31 11 0 "[ . 1 . 2]" 105 PHI 1 68 LYS C 1 69 GLU N 1 69 GLU CA 1 69 GLU C -66.00 -60.00 -65.76 -65.56 -65.84 1.36 16 0 "[ . 1 . 2]" 106 PSI 1 69 GLU N 1 69 GLU CA 1 69 GLU C 1 70 LEU N -38.00 -26.00 -26.32 -31.04 -23.63 2.37 5 0 "[ . 1 . 2]" 107 PHI 1 69 GLU C 1 70 LEU N 1 70 LEU CA 1 70 LEU C -91.00 -79.00 -79.36 -82.45 -77.16 1.84 14 0 "[ . 1 . 2]" 108 PSI 1 70 LEU N 1 70 LEU CA 1 70 LEU C 1 71 GLY N -13.00 3.00 -6.71 -13.68 3.41 0.68 7 0 "[ . 1 . 2]" 109 PHI 1 70 LEU C 1 71 GLY N 1 71 GLY CA 1 71 GLY C 84.00 92.00 88.33 83.11 93.37 1.37 8 0 "[ . 1 . 2]" 110 PSI 1 71 GLY N 1 71 GLY CA 1 71 GLY C 1 72 LEU N 6.00 18.00 17.33 18.05 17.05 1.44 3 0 "[ . 1 . 2]" 111 PHI 1 71 GLY C 1 72 LEU N 1 72 LEU CA 1 72 LEU C -99.00 -79.00 -85.03 -82.79 -84.03 1.37 3 0 "[ . 1 . 2]" 112 PSI 1 72 LEU N 1 72 LEU CA 1 72 LEU C 1 73 VAL N 145.00 159.00 145.35 143.23 153.49 1.77 3 0 "[ . 1 . 2]" 113 PHI 1 72 LEU C 1 73 VAL N 1 73 VAL CA 1 73 VAL C -134.00 -118.00 -129.06 -131.86 -133.00 0.81 10 0 "[ . 1 . 2]" 114 PSI 1 73 VAL N 1 73 VAL CA 1 73 VAL C 1 74 ASP N 154.00 166.00 159.62 152.69 166.10 1.31 18 0 "[ . 1 . 2]" 115 PHI 1 73 VAL C 1 74 ASP N 1 74 ASP CA 1 74 ASP C -67.00 -53.00 -64.74 -67.78 -56.85 0.78 10 0 "[ . 1 . 2]" 116 PSI 1 74 ASP N 1 74 ASP CA 1 74 ASP C 1 75 GLY N 125.00 135.00 132.26 126.19 136.02 1.02 13 0 "[ . 1 . 2]" 117 PHI 1 74 ASP C 1 75 GLY N 1 75 GLY CA 1 75 GLY C 90.00 98.00 98.54 96.43 99.57 1.57 4 0 "[ . 1 . 2]" 118 PSI 1 75 GLY N 1 75 GLY CA 1 75 GLY C 1 76 GLN N -18.00 -10.00 -9.40 -14.90 -7.22 2.78 19 0 "[ . 1 . 2]" 119 PHI 1 75 GLY C 1 76 GLN N 1 76 GLN CA 1 76 GLN C -84.00 -68.00 -72.39 -84.91 -66.32 1.68 17 0 "[ . 1 . 2]" 120 PSI 1 76 GLN N 1 76 GLN CA 1 76 GLN C 1 77 GLU N 135.00 144.00 141.81 140.85 139.47 3.98 7 0 "[ . 1 . 2]" 121 PHI 1 76 GLN C 1 77 GLU N 1 77 GLU CA 1 77 GLU C -116.00 -98.00 -100.01 -97.43 -97.43 4.69 7 0 "[ . 1 . 2]" 122 PSI 1 77 GLU N 1 77 GLU CA 1 77 GLU C 1 78 LEU N 120.00 136.00 126.97 119.46 136.45 0.54 11 0 "[ . 1 . 2]" 123 PHI 1 77 GLU C 1 78 LEU N 1 78 LEU CA 1 78 LEU C -123.00 -99.00 -104.52 -112.10 -119.30 0.66 18 0 "[ . 1 . 2]" 124 PSI 1 78 LEU N 1 78 LEU CA 1 78 LEU C 1 79 ALA N 126.00 138.00 137.74 125.69 141.25 3.25 11 0 "[ . 1 . 2]" 125 PHI 1 78 LEU C 1 79 ALA N 1 79 ALA CA 1 79 ALA C -119.00 -104.00 -103.66 -103.91 -106.81 3.72 11 0 "[ . 1 . 2]" 126 PSI 1 79 ALA N 1 79 ALA CA 1 79 ALA C 1 80 VAL N 117.00 127.00 120.29 118.32 117.21 1.34 18 0 "[ . 1 . 2]" 127 PHI 1 79 ALA C 1 80 VAL N 1 80 VAL CA 1 80 VAL C -123.00 -113.00 -113.90 -111.94 -112.48 3.19 18 0 "[ . 1 . 2]" 128 PSI 1 80 VAL N 1 80 VAL CA 1 80 VAL C 1 81 ALA N 124.00 132.00 131.05 135.18 134.94 3.59 2 0 "[ . 1 . 2]" 129 PHI 1 80 VAL C 1 81 ALA N 1 81 ALA CA 1 81 ALA C -131.00 -118.00 -119.23 -114.29 -115.14 3.71 2 0 "[ . 1 . 2]" 130 PSI 1 81 ALA N 1 81 ALA CA 1 81 ALA C 1 82 ASP N 137.00 147.00 141.76 135.98 135.78 2.98 13 0 "[ . 1 . 2]" 131 PHI 1 81 ALA C 1 82 ASP N 1 82 ASP CA 1 82 ASP C -139.00 -119.00 -119.17 -129.57 -114.04 4.96 13 0 "[ . 1 . 2]" 132 PSI 1 82 ASP N 1 82 ASP CA 1 82 ASP C 1 83 VAL N 148.00 162.00 157.45 149.30 162.51 0.51 9 0 "[ . 1 . 2]" 133 PHI 1 82 ASP C 1 83 VAL N 1 83 VAL CA 1 83 VAL C -86.00 -70.00 -83.09 -86.45 -87.06 1.33 1 0 "[ . 1 . 2]" 134 PSI 1 83 VAL N 1 83 VAL CA 1 83 VAL C 1 84 THR N -38.00 -24.00 -26.21 -38.22 -22.92 1.08 3 0 "[ . 1 . 2]" 135 PHI 1 83 VAL C 1 84 THR N 1 84 THR CA 1 84 THR C -98.00 -82.00 -95.62 -100.35 -87.27 2.35 15 0 "[ . 1 . 2]" 136 PSI 1 84 THR N 1 84 THR CA 1 84 THR C 1 85 THR N -23.00 -5.00 -20.85 -25.93 -9.77 2.93 16 0 "[ . 1 . 2]" 137 PHI 1 84 THR C 1 85 THR N 1 85 THR CA 1 85 THR C -123.00 -101.00 -114.77 -106.76 -110.50 2.04 16 0 "[ . 1 . 2]" 138 PSI 1 85 THR N 1 85 THR CA 1 85 THR C 1 86 PRO N 130.00 144.00 129.53 128.57 128.31 2.68 9 0 "[ . 1 . 2]" 139 PHI 1 87 GLN C 1 88 THR N 1 88 THR CA 1 88 THR C -104.00 -80.00 -94.15 -89.65 -90.98 0.88 17 0 "[ . 1 . 2]" 140 PSI 1 88 THR N 1 88 THR CA 1 88 THR C 1 89 VAL N 126.00 136.00 129.96 124.24 136.62 1.76 18 0 "[ . 1 . 2]" 141 PHI 1 88 THR C 1 89 VAL N 1 89 VAL CA 1 89 VAL C -125.00 -101.00 -109.75 -106.25 -111.40 0.70 8 0 "[ . 1 . 2]" 142 PSI 1 89 VAL N 1 89 VAL CA 1 89 VAL C 1 90 LEU N 124.00 138.00 138.36 131.16 139.52 1.52 11 0 "[ . 1 . 2]" 143 PHI 1 89 VAL C 1 90 LEU N 1 90 LEU CA 1 90 LEU C -114.00 -95.00 -100.17 -99.55 -100.02 0.90 6 0 "[ . 1 . 2]" 144 PSI 1 90 LEU N 1 90 LEU CA 1 90 LEU C 1 91 PHE N 125.00 142.00 133.60 124.90 142.14 0.14 4 0 "[ . 1 . 2]" 145 PHI 1 90 LEU C 1 91 PHE N 1 91 PHE CA 1 91 PHE C -128.00 -118.00 -121.85 -122.81 -126.25 0.86 15 0 "[ . 1 . 2]" 146 PSI 1 91 PHE N 1 91 PHE CA 1 91 PHE C 1 92 LYS N 139.00 149.00 141.24 136.90 149.67 2.10 18 0 "[ . 1 . 2]" 147 PHI 1 91 PHE C 1 92 LYS N 1 92 LYS CA 1 92 LYS C -131.00 -101.00 -105.07 -105.28 -105.48 0.84 10 0 "[ . 1 . 2]" 148 PSI 1 92 LYS N 1 92 LYS CA 1 92 LYS C 1 93 LEU N 119.00 137.00 125.64 118.56 134.30 0.44 7 0 "[ . 1 . 2]" 149 PHI 1 92 LYS C 1 93 LEU N 1 93 LEU CA 1 93 LEU C -113.00 -98.00 -97.94 -100.10 -96.82 1.18 8 0 "[ . 1 . 2]" 150 PSI 1 93 LEU N 1 93 LEU CA 1 93 LEU C 1 94 HIS N 122.00 130.00 122.04 121.90 121.76 0.97 1 0 "[ . 1 . 2]" 151 PHI 1 93 LEU C 1 94 HIS N 1 94 HIS CA 1 94 HIS C -117.00 -103.00 -118.23 -117.22 -117.59 1.94 11 0 "[ . 1 . 2]" 152 PSI 1 94 HIS N 1 94 HIS CA 1 94 HIS C 1 95 PHE N 113.00 127.00 127.93 127.36 127.08 3.59 15 0 "[ . 1 . 2]" 153 PHI 1 94 HIS C 1 95 PHE N 1 95 PHE CA 1 95 PHE C -109.00 -98.00 -97.38 -97.15 -97.34 3.35 15 0 "[ . 1 . 2]" 154 PSI 1 95 PHE N 1 95 PHE CA 1 95 PHE C 1 96 THR N 118.00 138.00 128.01 115.64 140.99 2.99 13 0 "[ . 1 . 2]" 155 PHI 1 95 PHE C 1 96 THR N 1 96 THR CA 1 96 THR C -101.00 -83.00 -96.85 -83.71 -90.22 3.96 13 0 "[ . 1 . 2]" 156 PSI 1 96 THR N 1 96 THR CA 1 96 THR C 1 97 SER N 140.00 164.00 140.82 137.43 148.35 2.57 2 0 "[ . 1 . 2]" stop_ save_
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