data_3ait_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3ait _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.5 t70 . . . . . 0 N--CA 1.47 0.558 0 N-CA-C 106.762 -1.57 . . . . 14.140000000000001 106.762 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 m 69.34 -65.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.7 1.6 . . . . 15.73 112.764 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.4 m -146.45 141.56 27.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.897 1.279 . . . . 13.539999999999999 107.705 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.0 p -165.66 159.94 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.808 0.843 . . . . 8.9000000000000004 108.978 -176.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 63.2 m -67.94 -77.81 0.07 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.225 -0.657 . . . . 3.7400000000000002 109.225 172.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 71.65 122.2 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 127.869 2.467 . . . . 3.4900000000000002 112.888 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -62.05 145.99 96.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.758 2.305 . . . . 1.1000000000000001 112.44 -172.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.62 156.31 92.13 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 123.901 0.881 . . . . 1.5900000000000001 110.058 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.95 144.5 43.13 Favored 'Trans proline' 0 N--CA 1.445 -1.336 0 C-N-CA 121.749 1.633 . . . . 0.92000000000000004 108.749 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.5 p -60.84 -6.99 2.04 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.575 1.15 . . . . 2.4100000000000001 113.179 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 p -74.63 -19.53 60.26 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 118.833 -0.603 . . . . 0.71999999999999997 112.167 173.359 66.907 157.28 -84.183 104.842 2.08 99.667 93.603 -131.987 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.2 t -98.15 132.97 42.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 108.13 -1.063 . . . . 2.04 108.13 174.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.2 m -97.39 152.09 19.29 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.582 1.153 . . . . 3.1099999999999999 108.911 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.0 tp -109.49 143.86 38.54 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 127.07 2.148 . . . . 1.5900000000000001 106.828 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 62.88 1.64 Allowed 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.74 1.616 . . . . 2.1099999999999999 108.354 -172.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -78.94 98.17 6.31 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.785 -1.166 . . . . 1.8200000000000001 109.48 172.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.2 p -85.31 -176.2 6.03 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.127 -1.064 . . . . 1.4299999999999999 108.127 166.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -70.56 -32.78 70.33 Favored 'General case' 0 C--O 1.224 -0.276 0 O-C-N 121.069 -1.019 . . . . 2.1200000000000001 109.932 164.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -72.24 -41.31 66.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.36 0.664 . . . . 6.4500000000000002 110.678 -171.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -168.78 169.14 10.14 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.82 0.848 . . . . 9.6199999999999992 110.709 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -91.34 114.75 27.37 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.748 1.219 . . . . 2.6800000000000002 108.535 160.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.76 154.39 18.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.113 1.365 . . . . 4.0599999999999996 107.521 173.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.71 135.2 50.81 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.396 -1.335 . . . . 2.0800000000000001 107.396 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -121.73 109.82 15.18 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.952 1.701 . . . . 2.3599999999999999 107.359 -173.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.8 t-20 -79.64 86.8 5.23 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.108 -0.37 . . . . 0.46999999999999997 110.096 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.38 14.57 15.91 Favored Glycine 0 CA--C 1.535 1.298 0 CA-C-O 119.495 -0.614 . . . . 0.73999999999999999 112.719 170.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.64 168.63 13.44 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 118.869 1.335 . . . . 1.5800000000000001 110.733 178.341 -131.987 93.603 -84.183 99.667 2.08 104.842 157.28 66.907 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -83.69 -13.63 53.66 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.371 0.668 . . . . 2.1699999999999999 112.237 176.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -123.3 161.91 23.71 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.551 1.14 . . . . 3.8999999999999999 110.83 -171.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -69.09 134.43 49.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.646 -0.872 . . . . 1.8100000000000001 108.646 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.88 155.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.083 0 N-CA-C 108.79 -0.818 . . . . 2.02 108.79 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -114.55 123.58 49.71 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.113 -1.069 . . . . 1.78 108.113 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 19.2 m -120.45 149.06 23.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 123.443 0.697 . . . . 1.5700000000000001 111.174 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -126.98 112.71 15.57 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.999 1.719 . . . . 3.2000000000000002 108.284 170.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.8 133.4 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 121.222 -0.924 . . . . 1.8700000000000001 109.592 173.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.3 t -112.58 136.48 48.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 107.628 -1.249 . . . . 1.76 107.628 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -112.38 166.18 11.53 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.135 0.791 . . . . 1.54 113.135 -166.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -42.69 -45.38 4.68 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.89 1.676 . . . . 3.0899999999999999 111.397 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -89.53 24.87 2.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.824 1.649 . . . . 2.3399999999999999 111.535 -173.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 52.93 41.07 31.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.255 1.422 . . . . 3.9500000000000002 112.019 170.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 p -104.96 167.15 9.89 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 107.91 -1.145 . . . . 3.6800000000000002 107.91 161.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.66 122.11 41.75 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.767 1.627 . . . . 1.74 107.31 169.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.6 41.47 2.7 Favored Glycine 0 N--CA 1.465 0.579 0 C-N-CA 125.991 1.758 . . . . 3.2999999999999998 112.613 -169.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 mt 67.09 149.99 0.06 Allowed 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 130.923 3.689 . . . . 3.3199999999999998 111.216 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.88 117.45 30.16 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 112.765 -2.016 . . . . 2.0499999999999998 107.952 -171.585 -138.517 -160.569 152.904 102.659 2.074 100.852 75.636 -114.875 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -127.48 129.25 47.11 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.571 0.749 . . . . 2.48 109.656 -168.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.31 128.04 32.83 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 125.507 1.523 . . . . 1.6699999999999999 109.549 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.18 126.43 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 124.136 0.974 . . . . 2.0800000000000001 108.491 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.57 159.25 82.03 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 125.372 1.469 . . . . 2.1299999999999999 110.12 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -63.93 125.34 15.13 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 122.064 1.842 . . . . 0.72999999999999998 109.298 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.58 7.25 87.17 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 118.747 -1.029 . . . . 1.01 113.077 -173.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -89.15 150.81 22.53 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 119.477 1.639 . . . . 3.75 107.439 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 7.8 mm -128.05 126.37 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 103.767 -2.679 . . . . 2.6099999999999999 103.767 -177.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.86 147.48 28.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.793 1.178 . . . . 2.0 109.731 -175.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.98 138.96 36.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.089 0.955 . . . . 1.9399999999999999 111.884 -176.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.82 2.12 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.814 1.246 . . . . 1.8300000000000001 113.51 -166.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.87 43.97 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 119.208 -1.472 . . . . 2.3900000000000001 113.539 172.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -68.56 157.09 36.78 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.435 1.494 . . . . 5.04 110.804 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.35 171.37 41.96 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.966 -1.254 . . . . 1.8 109.966 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -75.89 19.03 0.23 Allowed 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.619 1.34 . . . . 2.4900000000000002 114.619 -169.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.61 -13.22 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.447 -1.408 . . . . 3.8500000000000001 112.565 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 122.43 -8.05 9.63 Favored Glycine 0 C--N 1.34 0.79 0 C-N-CA 123.476 0.56 . . . . 3.5299999999999998 113.834 169.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -54.2 -55.83 24.14 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.038 0.935 . . . . 3.8999999999999999 112.911 -169.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -111.55 60.01 0.62 Allowed 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 105.703 -1.962 . . . . 2.8500000000000001 105.703 159.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 49.35 -110.61 0.81 Allowed Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.231 -0.748 . . . . 1.3100000000000001 111.231 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.0 m170 -134.2 160.26 38.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.052 -1.462 . . . . 2.1200000000000001 107.052 169.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.51 144.79 56.94 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 123.758 0.823 . . . . 1.8100000000000001 108.815 163.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -92.56 -53.54 4.15 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.728 1.611 . . . . 7.0199999999999996 108.416 167.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -165.52 164.29 19.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.979 -0.749 . . . . 1.8700000000000001 108.979 -173.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 83.8 mt -81.86 134.65 35.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.933 -1.136 . . . . 2.0800000000000001 107.933 162.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -106.37 155.32 19.65 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.811 1.244 . . . . 1.6299999999999999 108.031 166.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -74.95 169.54 17.76 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.982 0.81 . . . . 4.9100000000000001 109.074 172.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.15 -48.47 11.29 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 121.714 -0.616 . . . . 2.9500000000000002 112.202 155.599 -114.875 75.636 152.904 100.852 2.074 102.659 -160.569 -138.517 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.2 mt . . . . . 0 C--N 1.326 -0.417 0 C-N-CA 126.457 1.903 . . . . 5.2699999999999996 107.982 177.888 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.5 t70 . . . . . 0 N--CA 1.47 0.558 0 N-CA-C 106.762 -1.57 . . . . 14.14 106.762 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 m 69.34 -65.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.7 1.6 . . . . 14.8 112.764 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.4 m -146.45 141.56 27.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.897 1.279 . . . . 12.94 107.705 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.0 p -165.66 159.94 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.808 0.843 . . . . 7.85 108.978 -176.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 63.2 m -67.94 -77.81 0.07 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.225 -0.657 . . . . 3.74 109.225 172.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 71.65 122.2 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 127.869 2.467 . . . . 3.49 112.888 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -62.05 145.99 96.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.758 2.305 . . . . 0.93 112.44 -172.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.62 156.31 92.13 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 123.901 0.881 . . . . 0.61 110.058 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.95 144.5 43.13 Favored 'Trans proline' 0 N--CA 1.445 -1.336 0 C-N-CA 121.749 1.633 . . . . 0.76 108.749 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.5 p -60.84 -6.99 2.04 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.575 1.15 . . . . 1.8 113.179 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 p -74.63 -19.53 60.26 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 118.833 -0.603 . . . . 0.61 112.167 173.359 66.907 157.28 -84.183 104.842 2.08 99.667 93.603 -131.987 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.2 t -98.15 132.97 42.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 108.13 -1.063 . . . . 0.68 108.13 174.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.2 m -97.39 152.09 19.29 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.582 1.153 . . . . 1.77 108.911 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.0 tp -109.49 143.86 38.54 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 127.07 2.148 . . . . 0.73 106.828 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 62.88 1.64 Allowed 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.74 1.616 . . . . 1.96 108.354 -172.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.416 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 46.6 tt0 -78.94 98.17 6.31 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.785 -1.166 . . . . 1.75 109.48 172.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.2 p -85.31 -176.2 6.03 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.127 -1.064 . . . . 1.2 108.127 166.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -70.56 -32.78 70.33 Favored 'General case' 0 C--O 1.224 -0.276 0 O-C-N 121.069 -1.019 . . . . 1.84 109.932 164.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -72.24 -41.31 66.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.36 0.664 . . . . 5.28 110.678 -171.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -168.78 169.14 10.14 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.82 0.848 . . . . 8.33 110.709 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -91.34 114.75 27.37 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.748 1.219 . . . . 2.0 108.535 160.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.429 ' OE1' HG22 ' A' ' 53' ' ' ILE . 1.5 tm0? -100.76 154.39 18.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.113 1.365 . . . . 2.8 107.521 173.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.71 135.2 50.81 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.396 -1.335 . . . . 0.79 107.396 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -121.73 109.82 15.18 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.952 1.701 . . . . 2.36 107.359 -173.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.8 t-20 -79.64 86.8 5.23 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.108 -0.37 . . . . 0.47 110.096 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.38 14.57 15.91 Favored Glycine 0 CA--C 1.535 1.298 0 CA-C-O 119.495 -0.614 . . . . 0.74 112.719 170.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.64 168.63 13.44 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 118.869 1.335 . . . . 1.58 110.733 178.341 -131.987 93.603 -84.183 99.667 2.08 104.842 157.28 66.907 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -83.69 -13.63 53.66 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.371 0.668 . . . . 1.47 112.237 176.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -123.3 161.91 23.71 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.551 1.14 . . . . 3.9 110.83 -171.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -69.09 134.43 49.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.646 -0.872 . . . . 0.72 108.646 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.88 155.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.083 0 N-CA-C 108.79 -0.818 . . . . 0.44 108.79 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -114.55 123.58 49.71 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.113 -1.069 . . . . 0.6 108.113 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 19.2 m -120.45 149.06 23.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 123.443 0.697 . . . . 0.54 111.174 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -126.98 112.71 15.57 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.999 1.719 . . . . 2.32 108.284 170.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.531 HG23 HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -66.8 133.4 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 121.222 -0.924 . . . . 0.77 109.592 173.155 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.3 t -112.58 136.48 48.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 107.628 -1.249 . . . . 0.53 107.628 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -112.38 166.18 11.53 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.135 0.791 . . . . 1.21 113.135 -166.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -42.69 -45.38 4.68 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.89 1.676 . . . . 2.96 111.397 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -89.53 24.87 2.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.824 1.649 . . . . 2.34 111.535 -173.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 52.93 41.07 31.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.255 1.422 . . . . 3.95 112.019 170.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 p -104.96 167.15 9.89 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 107.91 -1.145 . . . . 1.9 107.91 161.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.66 122.11 41.75 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.767 1.627 . . . . 1.74 107.31 169.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.6 41.47 2.7 Favored Glycine 0 N--CA 1.465 0.579 0 C-N-CA 125.991 1.758 . . . . 3.3 112.613 -169.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 mt 67.09 149.99 0.06 Allowed 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 130.923 3.689 . . . . 2.27 111.216 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.88 117.45 30.16 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 112.765 -2.016 . . . . 2.05 107.952 -171.585 -138.517 -160.569 152.904 102.659 2.074 100.852 75.636 -114.875 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -127.48 129.25 47.11 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.571 0.749 . . . . 1.91 109.656 -168.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.31 128.04 32.83 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 125.507 1.523 . . . . 0.62 109.549 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.18 126.43 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 124.136 0.974 . . . . 0.61 108.491 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.57 159.25 82.03 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 125.372 1.469 . . . . 0.77 110.12 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -63.93 125.34 15.13 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 122.064 1.842 . . . . 0.7 109.298 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.58 7.25 87.17 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 118.747 -1.029 . . . . 1.01 113.077 -173.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -89.15 150.81 22.53 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 119.477 1.639 . . . . 3.75 107.439 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.429 HG22 ' OE1' ' A' ' 22' ' ' GLN . 7.8 mm -128.05 126.37 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 103.767 -2.679 . . . . 1.3 103.767 -177.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.404 ' CA ' HE22 ' A' ' 22' ' ' GLN . 0.3 OUTLIER -148.86 147.48 28.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.793 1.178 . . . . 1.22 109.731 -175.796 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.98 138.96 36.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.089 0.955 . . . . 0.83 111.884 -176.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.82 2.12 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.814 1.246 . . . . 1.61 113.51 -166.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.87 43.97 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 119.208 -1.472 . . . . 2.14 113.539 172.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -68.56 157.09 36.78 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.435 1.494 . . . . 5.04 110.804 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.35 171.37 41.96 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.966 -1.254 . . . . 0.93 109.966 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -75.89 19.03 0.23 Allowed 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.619 1.34 . . . . 1.6 114.619 -169.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.61 -13.22 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.447 -1.408 . . . . 2.94 112.565 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 122.43 -8.05 9.63 Favored Glycine 0 C--N 1.34 0.79 0 C-N-CA 123.476 0.56 . . . . 2.47 113.834 169.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -54.2 -55.83 24.14 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.038 0.935 . . . . 3.5 112.911 -169.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -111.55 60.01 0.62 Allowed 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 105.703 -1.962 . . . . 2.34 105.703 159.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 49.35 -110.61 0.81 Allowed Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.231 -0.748 . . . . 1.1 111.231 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.0 m170 -134.2 160.26 38.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.052 -1.462 . . . . 1.62 107.052 169.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.416 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -64.51 144.79 56.94 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 123.758 0.823 . . . . 1.06 108.815 163.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -92.56 -53.54 4.15 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.728 1.611 . . . . 6.05 108.416 167.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -165.52 164.29 19.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.979 -0.749 . . . . 0.97 108.979 -173.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.531 HD23 HG23 ' A' ' 35' ' ' VAL . 83.8 mt -81.86 134.65 35.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.933 -1.136 . . . . 0.67 107.933 162.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -106.37 155.32 19.65 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.811 1.244 . . . . 0.51 108.031 166.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -74.95 169.54 17.76 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.982 0.81 . . . . 4.01 109.074 172.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.15 -48.47 11.29 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 121.714 -0.616 . . . . 2.95 112.202 155.599 -114.875 75.636 152.904 100.852 2.074 102.659 -160.569 -138.517 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.2 mt . . . . . 0 C--N 1.326 -0.417 0 C-N-CA 126.457 1.903 . . . . 5.27 107.982 177.888 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 7.5 t70 . . . . . 0 N--CA 1.47 0.558 0 N-CA-C 106.762 -1.57 . . . . 14.140000000000001 106.762 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 m 69.34 -65.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.7 1.6 . . . . 14.800000000000001 112.764 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.4 m -146.45 141.56 27.24 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 124.897 1.279 . . . . 12.94 107.705 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.0 p -165.66 159.94 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.808 0.843 . . . . 7.8499999999999996 108.978 -176.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 63.2 m -67.94 -77.81 0.07 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.225 -0.657 . . . . 3.7400000000000002 109.225 172.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 71.65 122.2 0.03 OUTLIER Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 127.869 2.467 . . . . 3.4900000000000002 112.888 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -62.05 145.99 96.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 122.758 2.305 . . . . 0.93000000000000005 112.44 -172.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -70.62 156.31 92.13 Favored Pre-proline 0 N--CA 1.453 -0.282 0 C-N-CA 123.901 0.881 . . . . 0.60999999999999999 110.058 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.95 144.5 43.13 Favored 'Trans proline' 0 N--CA 1.445 -1.336 0 C-N-CA 121.749 1.633 . . . . 0.76000000000000001 108.749 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.5 p -60.84 -6.99 2.04 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.575 1.15 . . . . 1.8 113.179 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 p -74.63 -19.53 60.26 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 118.833 -0.603 . . . . 0.60999999999999999 112.167 173.359 66.907 157.28 -84.183 104.842 2.08 99.667 93.603 -131.987 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 51.2 t -98.15 132.97 42.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 N-CA-C 108.13 -1.063 . . . . 0.68000000000000005 108.13 174.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.2 m -97.39 152.09 19.29 Favored 'General case' 0 N--CA 1.433 -1.323 0 C-N-CA 124.582 1.153 . . . . 1.77 108.911 177.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.0 tp -109.49 143.86 38.54 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 127.07 2.148 . . . . 0.72999999999999998 106.828 177.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 62.88 1.64 Allowed 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.74 1.616 . . . . 1.96 108.354 -172.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.416 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 46.6 tt0 -78.94 98.17 6.31 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 118.785 -1.166 . . . . 1.75 109.48 172.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 98.2 p -85.31 -176.2 6.03 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.127 -1.064 . . . . 1.2 108.127 166.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 43.1 p-90 -70.56 -32.78 70.33 Favored 'General case' 0 C--O 1.224 -0.276 0 O-C-N 121.069 -1.019 . . . . 1.8400000000000001 109.932 164.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 tpm_? -72.24 -41.31 66.95 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.36 0.664 . . . . 5.2800000000000002 110.678 -171.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -168.78 169.14 10.14 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.82 0.848 . . . . 8.3300000000000001 110.709 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.8 t -91.34 114.75 27.37 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 124.748 1.219 . . . . 2.0 108.535 160.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.579 ' NE2' HG22 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -100.76 154.39 18.66 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.113 1.365 . . . . 2.7999999999999998 107.521 173.061 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -126.71 135.2 50.81 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.396 -1.335 . . . . 0.79000000000000004 107.396 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -121.73 109.82 15.18 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.952 1.701 . . . . 2.3599999999999999 107.359 -173.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.8 t-20 -79.64 86.8 5.23 Favored 'General case' 0 C--N 1.339 0.15 0 O-C-N 122.108 -0.37 . . . . 0.46999999999999997 110.096 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -79.38 14.57 15.91 Favored Glycine 0 CA--C 1.535 1.298 0 CA-C-O 119.495 -0.614 . . . . 0.73999999999999999 112.719 170.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.64 168.63 13.44 Favored 'General case' 0 C--N 1.339 0.11 0 CA-C-N 118.869 1.335 . . . . 1.5800000000000001 110.733 178.341 -131.987 93.603 -84.183 99.667 2.08 104.842 157.28 66.907 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -83.69 -13.63 53.66 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.371 0.668 . . . . 1.47 112.237 176.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -123.3 161.91 23.71 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.551 1.14 . . . . 3.8999999999999999 110.83 -171.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 19.6 m -69.09 134.43 49.35 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.646 -0.872 . . . . 0.71999999999999997 108.646 168.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.88 155.92 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.083 0 N-CA-C 108.79 -0.818 . . . . 0.44 108.79 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.3 m -114.55 123.58 49.71 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.113 -1.069 . . . . 0.59999999999999998 108.113 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 19.2 m -120.45 149.06 23.27 Favored 'Isoleucine or valine' 0 C--N 1.341 0.218 0 C-N-CA 123.443 0.697 . . . . 0.54000000000000004 111.174 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -126.98 112.71 15.57 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.999 1.719 . . . . 2.3199999999999998 108.284 170.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.531 HG23 HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -66.8 133.4 31.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 121.222 -0.924 . . . . 0.77000000000000002 109.592 173.155 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.3 t -112.58 136.48 48.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.129 0 N-CA-C 107.628 -1.249 . . . . 0.53000000000000003 107.628 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -112.38 166.18 11.53 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 113.135 0.791 . . . . 1.21 113.135 -166.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -42.69 -45.38 4.68 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.89 1.676 . . . . 2.96 111.397 174.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -89.53 24.87 2.14 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.824 1.649 . . . . 2.3399999999999999 111.535 -173.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 52.93 41.07 31.95 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.255 1.422 . . . . 3.9500000000000002 112.019 170.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 2.7 p -104.96 167.15 9.89 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 107.91 -1.145 . . . . 1.8999999999999999 107.91 161.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.66 122.11 41.75 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.767 1.627 . . . . 1.74 107.31 169.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -81.6 41.47 2.7 Favored Glycine 0 N--CA 1.465 0.579 0 C-N-CA 125.991 1.758 . . . . 3.2999999999999998 112.613 -169.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.3 mt 67.09 149.99 0.06 Allowed 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 130.923 3.689 . . . . 2.27 111.216 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.88 117.45 30.16 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 112.765 -2.016 . . . . 2.0499999999999998 107.952 -171.585 -138.517 -160.569 152.904 102.659 2.074 100.852 75.636 -114.875 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -127.48 129.25 47.11 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.571 0.749 . . . . 1.9099999999999999 109.656 -168.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -79.31 128.04 32.83 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 125.507 1.523 . . . . 0.62 109.549 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.0 t -131.18 126.43 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 124.136 0.974 . . . . 0.60999999999999999 108.491 179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.57 159.25 82.03 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 125.372 1.469 . . . . 0.77000000000000002 110.12 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -63.93 125.34 15.13 Favored 'Trans proline' 0 N--CA 1.453 -0.912 0 C-N-CA 122.064 1.842 . . . . 0.69999999999999996 109.298 -177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.58 7.25 87.17 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 118.747 -1.029 . . . . 1.01 113.077 -173.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -89.15 150.81 22.53 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 119.477 1.639 . . . . 3.75 107.439 169.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.579 HG22 ' NE2' ' A' ' 22' ' ' GLN . 7.8 mm -128.05 126.37 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 103.767 -2.679 . . . . 1.3 103.767 -177.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.86 147.48 28.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.793 1.178 . . . . 1.22 109.731 -175.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.98 138.96 36.06 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.089 0.955 . . . . 0.82999999999999996 111.884 -176.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 34.7 m -135.82 2.12 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 124.814 1.246 . . . . 1.6100000000000001 113.51 -166.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 172.78 -170.87 43.97 Favored Glycine 0 C--N 1.337 0.595 0 C-N-CA 119.208 -1.472 . . . . 2.1400000000000001 113.539 172.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -68.56 157.09 36.78 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.435 1.494 . . . . 5.04 110.804 177.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.35 171.37 41.96 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 109.966 -1.254 . . . . 0.93000000000000005 109.966 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -75.89 19.03 0.23 Allowed 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.619 1.34 . . . . 1.6000000000000001 114.619 -169.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.61 -13.22 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.021 0 O-C-N 120.447 -1.408 . . . . 2.9399999999999999 112.565 175.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 122.43 -8.05 9.63 Favored Glycine 0 C--N 1.34 0.79 0 C-N-CA 123.476 0.56 . . . . 2.4700000000000002 113.834 169.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -54.2 -55.83 24.14 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.038 0.935 . . . . 3.5 112.911 -169.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -111.55 60.01 0.62 Allowed 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 105.703 -1.962 . . . . 2.3399999999999999 105.703 159.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 49.35 -110.61 0.81 Allowed Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.231 -0.748 . . . . 1.1000000000000001 111.231 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 7.0 m170 -134.2 160.26 38.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 107.052 -1.462 . . . . 1.6200000000000001 107.052 169.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.416 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -64.51 144.79 56.94 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 123.758 0.823 . . . . 1.0600000000000001 108.815 163.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -92.56 -53.54 4.15 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.728 1.611 . . . . 6.0499999999999998 108.416 167.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.6 p90 -165.52 164.29 19.4 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.979 -0.749 . . . . 0.96999999999999997 108.979 -173.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.531 HD23 HG23 ' A' ' 35' ' ' VAL . 83.8 mt -81.86 134.65 35.43 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.933 -1.136 . . . . 0.67000000000000004 107.933 162.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -106.37 155.32 19.65 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.811 1.244 . . . . 0.51000000000000001 108.031 166.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.6 mtt180 -74.95 169.54 17.76 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 118.982 0.81 . . . . 4.0099999999999998 109.074 172.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -82.15 -48.47 11.29 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 121.714 -0.616 . . . . 2.9500000000000002 112.202 155.599 -114.875 75.636 152.904 100.852 2.074 102.659 -160.569 -138.517 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 96.2 mt . . . . . 0 C--N 1.326 -0.417 0 C-N-CA 126.457 1.903 . . . . 5.2699999999999996 107.982 177.888 . . . . . . . . 0 0 . 1 stop_ save_