data_2k0y_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 2k0y _Structure_validation_residue.Date_analyzed 2016-10-07 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 core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.6 tp . . . . . 0 N--CA 1.389 -3.509 0 N-CA-C 108.636 -0.876 . . . . 1.89 108.636 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.501 HD22 ' CE2' ' A' ' 56' ' ' TYR . 88.7 mt -116.19 130.91 57.02 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 108.193 -1.04 . . . . 1.38 108.193 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.3 p -102.02 -174.82 2.67 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 108.017 -1.105 . . . . 1.29 108.017 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.897 HG22 ' HA ' ' A' ' 29' ' ' ASP . 12.0 m -57.01 -45.71 82.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.02 0.438 . . . . 1.31 110.278 178.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 18.0 t70 -57.22 -45.17 84.12 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.861 0.864 . . . . 1.65 111.298 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -67.1 -39.66 86.75 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.367 0.603 . . . . 1.41 110.102 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 tp -65.94 -42.46 90.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.099 -0.955 . . . . 1.23 109.04 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.466 ' O ' HG22 ' A' ' 15' ' ' VAL . 39.0 ttm180 -53.02 -48.74 67.33 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.135 -0.939 . . . . 3.04 109.518 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.562 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 48.3 mtt180 -54.03 -44.53 71.06 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.016 -0.993 . . . . 4.47 111.648 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.93 91.7 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.53 0.519 . . . . 1.19 110.719 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.425 HD12 HG21 ' A' ' 48' ' ' THR . 9.4 mp -67.3 -31.64 72.07 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.998 0.37 . . . . 2.05 111.998 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 11' ' ' ARG . 95.6 t -64.75 -48.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 N-CA-C 108.581 -0.896 . . . . 1.33 108.581 175.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 47.0 mt-10 -58.14 -48.03 81.49 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.623 -0.717 . . . . 2.05 110.991 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.9 p . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.305 0.854 . . . . 1.66 113.305 -177.998 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.897 ' HA ' HG22 ' A' ' 7' ' ' THR . 5.2 m-20 . . . . . 0 CA--C 1.483 -1.609 0 N-CA-C 109.521 -0.548 . . . . 2.07 109.521 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.7 p90 -109.0 14.13 24.24 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.093 -0.706 . . . . 0.51 109.093 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.758 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 67.2 mt -53.54 -26.85 22.91 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 113.608 0.966 . . . . 1.12 113.608 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -95.11 -11.01 29.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.3 -0.409 . . . . 2.04 111.274 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp -82.05 116.25 21.56 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.659 -0.867 . . . . 2.01 108.659 175.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -75.7 149.89 37.99 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 115.287 -0.87 . . . . 4.79 110.426 -173.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HA ' HG12 ' A' ' 38' ' ' ILE . 56.7 m-85 -61.96 -39.84 93.52 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.423 -0.353 . . . . 0.43 111.097 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -58.01 -31.99 67.49 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.401 0.619 . . . . 2.79 111.137 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -82.37 -26.01 33.29 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.349 -0.841 . . . . 0.88 111.246 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.3 pt -98.07 14.42 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.097 0.475 . . . . 1.25 111.245 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.39 40.96 99.73 Favored Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.767 -0.651 . . . . 0.66 113.116 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.434 ' HB2' HG13 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -115.97 113.96 23.97 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.482 -0.562 . . . . 1.67 109.482 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -85.83 156.94 20.35 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.338 -0.616 . . . . 1.06 109.338 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 46' ' ' MET . 24.4 p -53.39 -33.75 54.99 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.108 0.781 . . . . 1.52 113.108 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.3 -49.13 70.66 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.927 -0.768 . . . . 2.24 108.927 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.51 96.62 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 109.605 -0.517 . . . . 1.13 109.605 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.448 HD21 HG21 ' A' ' 68' ' ' VAL . 63.8 tp -60.62 -41.65 95.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.995 -1.002 . . . . 1.15 111.223 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.8 mtp -61.68 -40.58 95.47 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-N 116.609 -0.269 . . . . 2.13 110.344 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.523 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 34.5 tt0 -65.42 -34.86 79.29 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.471 0.653 . . . . 1.88 110.511 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.425 HG21 HD12 ' A' ' 14' ' ' LEU . 60.1 m -64.03 -56.74 12.88 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 107.252 -1.388 . . . . 1.18 107.252 178.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.491 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.0 -36.27 70.21 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 113.923 -1.489 . . . . 1.02 109.995 176.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.516 ' HA ' ' OE1' ' A' ' 53' ' ' GLU . . . -58.68 -40.99 85.16 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.466 0.706 . . . . 1.12 112.414 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.523 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 62.6 mtp85 -63.35 -42.32 98.9 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.376 -0.972 . . . . 3.59 108.376 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.32 -41.75 89.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.389 -1.278 . . . . 1.61 111.185 178.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.516 ' OE1' ' HA ' ' A' ' 50' ' ' ALA . 50.2 mt-10 -55.81 -53.2 59.57 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 123.262 0.625 . . . . 0.48 109.836 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.8 m -62.49 -46.62 87.61 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 114.938 -1.028 . . . . 1.75 111.357 -178.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -65.46 -45.78 82.43 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.7 -0.682 . . . . 3.52 112.373 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.501 ' CE2' HD22 ' A' ' 5' ' ' LEU . 94.0 m-85 -97.19 6.37 48.55 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.179 0.807 . . . . 1.35 113.179 -175.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.29 52.72 49.82 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 115.984 -0.553 . . . . 0.93 112.188 177.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.513 HG12 HD13 ' A' ' 82' ' ' LEU . 28.6 m -132.86 176.52 8.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.665 -0.494 . . . . 1.72 109.665 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 t -141.9 129.62 21.62 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.95 -1.13 . . . . 2.39 107.95 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.482 HD11 ' HB3' ' A' ' 49' ' ' ALA . 92.9 mt -106.93 124.19 36.16 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.926 -0.579 . . . . 1.21 109.513 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 126.5 21.73 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.048 2.499 . . . . 1.09 111.719 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -52.99 -30.75 36.99 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.809 1.244 . . . . 1.83 113.43 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 11.4 t70 -69.82 -47.65 61.99 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.276 -0.639 . . . . 2.34 109.276 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -72.4 -33.25 45.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.495 -0.775 . . . . 1.24 110.618 -174.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.69 -27.42 62.89 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.862 -0.608 . . . . 1.13 111.443 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.85 19.43 8.91 Favored Glycine 0 N--CA 1.434 -1.455 0 N-CA-C 111.06 -0.816 . . . . 0.61 111.06 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 14.5 tpp180 -100.9 -19.27 15.98 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.254 -0.647 . . . . 4.72 109.254 -178.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.452 HG23 ' HB2' ' A' ' 74' ' ' LEU . 30.2 m -79.05 123.7 36.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-N 115.04 -0.982 . . . . 1.15 111.615 -177.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -91.71 -31.78 15.68 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.279 -0.873 . . . . 1.91 110.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 21.5 p -125.22 145.25 50.02 Favored Pre-proline 0 N--CA 1.418 -2.034 0 CA-C-N 115.337 -0.847 . . . . 1.16 110.395 -176.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.758 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 77.1 Cg_exo -54.03 -32.1 67.24 Favored 'Trans proline' 0 C--O 1.215 -0.648 0 C-N-CA 123.732 2.954 . . . . 0.36 113.192 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -52.9 -43.38 66.14 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.222 0.326 . . . . 1.84 111.774 176.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -64.55 -48.05 76.51 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.595 0.758 . . . . 2.13 109.978 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.452 ' HB2' HG23 ' A' ' 68' ' ' VAL . 3.4 tm? -66.4 -42.09 88.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.925 -1.034 . . . . 1.56 110.114 -176.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.07 -52.31 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.552 -0.536 . . . . 1.12 109.552 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.7 -43.32 94.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.5 -0.773 . . . . 0.57 111.763 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.61 -46.9 87.58 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 109.781 -0.451 . . . . 2.48 109.781 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.79 -35.42 55.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 C-N-CA 120.944 -0.302 . . . . 1.19 110.583 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -40.79 89.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 120.689 0.28 . . . . 1.14 110.47 175.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.01 -32.43 69.6 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.776 -0.647 . . . . 0.53 112.449 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.12 60.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.819 0.819 . . . . 1.22 109.641 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.513 HD13 HG12 ' A' ' 58' ' ' VAL . 8.5 mp -72.62 -6.7 46.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.075 -0.966 . . . . 1.97 111.724 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.549 0.69 . . . . 1.26 109.904 170.598 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.1 tp . . . . . 0 N--CA 1.418 -2.074 0 CA-C-O 121.485 0.66 . . . . 1.89 110.714 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 52' ' ' LEU . 73.8 mt -98.9 133.27 43.42 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.604 -0.726 . . . . 1.38 110.024 -178.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 p -99.92 -176.6 3.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.457 -1.312 . . . . 1.29 107.457 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.656 HG21 ' HA ' ' A' ' 29' ' ' ASP . 16.7 m -57.64 -38.86 75.76 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.11 -0.7 . . . . 1.31 109.11 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -60.03 -47.43 85.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.781 -1.1 . . . . 1.65 111.272 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.22 -39.76 89.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.835 -0.621 . . . . 1.41 110.098 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 17.3 tp -65.08 -45.05 86.85 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.943 -1.026 . . . . 1.23 109.265 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -50.75 -54.56 22.35 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 124.0 0.92 . . . . 3.04 109.914 177.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 23.3 ttp180 -56.05 -46.33 78.94 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.67 -1.15 . . . . 4.47 111.689 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.466 ' HB3' HD21 ' A' ' 52' ' ' LEU . . . -62.16 -40.65 96.7 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.367 0.417 . . . . 1.19 111.281 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.12 -38.65 91.82 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.634 0.254 . . . . 2.05 111.34 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.3 t -66.71 -47.59 82.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.857 -0.423 . . . . 1.33 109.857 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 45.9 mt-10 -59.37 -39.69 84.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.289 -0.414 . . . . 2.05 111.021 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.555 ' CB ' ' HA ' ' A' ' 48' ' ' THR . 20.6 m . . . . . 0 C--N 1.309 -1.16 0 CA-C-O 121.302 0.573 . . . . 1.66 112.114 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.656 ' HA ' HG21 ' A' ' 7' ' ' THR . 19.9 t70 . . . . . 0 N--CA 1.437 -1.116 0 N-CA-C 108.609 -0.885 . . . . 2.07 108.609 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.405 ' HB2' HD13 ' A' ' 33' ' ' LEU . 25.1 p90 -101.32 14.92 30.47 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.431 -0.35 . . . . 0.51 111.624 -175.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.707 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 41.0 mt -52.75 -25.62 11.72 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.919 1.451 . . . . 1.12 114.919 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -92.19 -16.94 25.56 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.945 0.402 . . . . 2.04 111.315 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD13 ' HB2' ' A' ' 30' ' ' PHE . 81.2 mt -77.53 114.78 16.72 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 121.308 0.575 . . . . 2.01 109.735 -176.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 46.1 mtp180 -72.64 141.01 48.31 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.19 -0.914 . . . . 4.79 109.903 -172.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.493 ' HA ' HG12 ' A' ' 38' ' ' ILE . 38.9 m-85 -60.69 -39.35 88.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.501 -0.318 . . . . 0.43 110.258 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -56.7 -31.78 64.83 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.517 0.727 . . . . 2.79 111.142 177.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -82.65 -34.34 27.52 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.087 -0.506 . . . . 0.88 110.91 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.493 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.1 pt -90.79 9.71 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 112.511 0.56 . . . . 1.25 112.511 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.51 29.88 31.63 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.639 -0.709 . . . . 0.66 114.401 174.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.476 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 8.6 m-85 -111.59 121.46 45.21 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 117.25 0.525 . . . . 1.67 111.271 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -84.65 152.62 23.66 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 107.093 -1.447 . . . . 1.06 107.093 173.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 46' ' ' MET . 13.5 p -54.27 -30.44 50.57 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.914 0.709 . . . . 1.52 112.914 176.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.33 -52.37 54.32 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.08 -0.711 . . . . 2.24 109.08 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.26 -33.04 74.63 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.372 0.606 . . . . 1.13 110.247 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.526 ' O ' ' HB ' ' A' ' 48' ' ' THR . 44.8 tp -63.48 -46.73 84.81 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.51 -0.768 . . . . 1.15 110.199 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.44 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.8 mtm -63.92 -33.95 76.87 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.392 -0.367 . . . . 2.13 111.129 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.9 -33.48 75.41 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 121.957 0.884 . . . . 1.88 109.032 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.555 ' HA ' ' CB ' ' A' ' 17' ' ' SER . 86.5 m -68.99 -62.21 1.47 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.747 -1.115 . . . . 1.18 108.845 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.408 ' HB3' ' CD1' ' A' ' 60' ' ' ILE . . . -56.77 -25.32 54.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.912 -1.04 . . . . 1.02 111.575 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -43.65 84.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 123.288 0.635 . . . . 1.12 110.668 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -66.38 -37.41 85.21 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.108 -0.951 . . . . 3.59 110.769 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.52 HD12 HD11 ' A' ' 5' ' ' LEU . 3.9 mm? -62.66 -43.7 98.14 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 122.315 0.246 . . . . 1.61 110.431 177.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.0 -48.15 80.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 123.67 0.606 . . . . 0.48 110.638 175.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 m -63.4 -53.96 44.25 Favored 'General case' 0 CA--C 1.559 1.29 0 CA-C-O 121.196 0.522 . . . . 1.75 112.282 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -62.3 -38.04 87.87 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.948 0.899 . . . . 3.52 112.938 -174.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -102.29 -1.24 31.49 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 114.098 1.148 . . . . 1.35 114.098 -177.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.79 52.14 52.58 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 111.195 -0.762 . . . . 0.93 111.195 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.542 HG23 ' H ' ' A' ' 59' ' ' SER . 7.4 p -136.18 178.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 108.287 -1.005 . . . . 1.72 108.287 -174.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.542 ' H ' HG23 ' A' ' 58' ' ' VAL . 7.0 p -138.59 137.33 36.87 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-O 121.032 0.444 . . . . 2.39 109.977 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 49' ' ' ALA . 87.2 mt -113.53 132.74 22.39 Favored Pre-proline 0 C--N 1.293 -1.881 0 N-CA-C 108.628 -0.878 . . . . 1.21 108.628 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -61.71 123.36 12.53 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 122.196 1.93 . . . . 1.09 111.012 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -53.42 -31.74 46.6 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.315 1.046 . . . . 1.83 111.018 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.66 -49.16 69.63 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.853 -1.067 . . . . 2.34 111.04 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.7 HG11 ' HG ' ' A' ' 77' ' ' LEU . 40.9 t -72.88 -33.81 44.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 109.805 -0.443 . . . . 1.24 109.805 -176.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.413 ' HB1' ' HG2' ' A' ' 46' ' ' MET . . . -58.05 -24.43 58.35 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.979 0.733 . . . . 1.13 112.979 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.63 2.81 34.25 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.495 -0.86 . . . . 0.61 112.364 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -108.1 -9.54 15.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.298 0.481 . . . . 4.72 112.298 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.521 HG22 HD23 ' A' ' 45' ' ' LEU . 15.5 m -79.35 111.42 16.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 121.465 0.65 . . . . 1.15 111.448 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -91.87 -31.93 15.5 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-N 115.667 -0.697 . . . . 1.91 110.219 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.1 p -121.69 145.31 42.76 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 115.325 -0.852 . . . . 1.16 111.016 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.707 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 56.8 Cg_exo -55.83 -34.17 90.57 Favored 'Trans proline' 0 C--O 1.212 -0.78 0 C-N-CA 123.916 3.078 . . . . 0.36 113.214 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.412 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 3.5 ptp180 -51.8 -45.86 64.02 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.346 0.403 . . . . 1.84 111.804 176.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -64.54 -44.83 89.56 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.532 0.682 . . . . 2.13 110.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.84 -47.65 68.39 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.952 -1.022 . . . . 1.56 110.657 -177.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 40.8 tp -58.48 -51.77 68.45 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.635 0.374 . . . . 1.12 110.95 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -58.71 -38.54 78.53 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.324 0.39 . . . . 0.57 110.93 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.7 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -62.49 -49.81 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.444 -0.576 . . . . 2.48 109.444 178.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.6 mt -67.34 -36.87 77.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.455 -0.339 . . . . 1.19 110.248 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -61.79 -37.06 82.96 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.873 -0.418 . . . . 1.14 109.873 176.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.51 -37.13 78.15 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.68 -0.691 . . . . 0.53 111.944 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.19 -44.86 67.83 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.189 0.519 . . . . 1.22 109.957 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.8 mt -66.96 -20.55 65.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 1.97 111.692 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.774 0 C-N-CA 122.979 0.511 . . . . 1.26 110.898 177.329 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 29.8 tp . . . . . 0 N--CA 1.388 -3.55 0 N-CA-C 103.937 -2.616 . . . . 1.89 103.937 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.437 ' HG ' HD13 ' A' ' 82' ' ' LEU . 92.1 mt -89.53 123.05 33.28 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 108.82 -0.807 . . . . 1.38 108.82 178.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.7 p -101.87 -173.91 2.46 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 107.313 -1.365 . . . . 1.29 107.313 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.486 HG23 ' HA ' ' A' ' 29' ' ' ASP . 27.6 m -57.23 -42.47 81.45 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.153 -0.684 . . . . 1.31 109.153 173.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.28 -48.91 79.85 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.424 1.089 . . . . 1.65 110.821 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -68.79 -39.54 80.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 116.027 -0.533 . . . . 1.41 111.421 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 18.6 tp -67.01 -45.2 78.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.795 -0.638 . . . . 1.23 109.978 -177.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.473 ' O ' HG21 ' A' ' 15' ' ' VAL . 43.8 ttp-105 -53.81 -45.78 70.91 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.559 -0.746 . . . . 3.04 109.882 177.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.555 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 66.9 mtp180 -55.84 -43.82 77.4 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.058 -0.974 . . . . 4.47 112.11 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.18 -45.43 94.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 123.73 0.644 . . . . 1.19 110.217 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 mp -65.52 -30.8 71.6 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.245 0.461 . . . . 2.05 112.245 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.473 HG21 ' O ' ' A' ' 11' ' ' ARG . 48.2 t -72.83 -34.69 47.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.156 -0.683 . . . . 1.33 109.156 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 44.2 mt-10 -66.19 -42.04 89.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.455 -0.338 . . . . 2.05 111.493 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.566 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 4.7 p . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 113.896 1.073 . . . . 1.66 113.896 -177.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.486 ' HA ' HG23 ' A' ' 7' ' ' THR . 3.8 m-20 . . . . . 0 CA--C 1.495 -1.144 0 N-CA-C 108.32 -0.993 . . . . 2.07 108.32 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 14.9 p90 -128.86 11.81 6.15 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.734 -0.786 . . . . 0.51 111.348 -177.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.828 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 44.8 mt -53.02 -29.13 27.7 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.735 1.383 . . . . 1.12 114.735 -176.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -98.73 -6.08 30.18 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.964 0.411 . . . . 2.04 111.842 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.7 mp -82.33 124.51 30.05 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.807 -0.812 . . . . 2.01 108.807 178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -76.04 143.58 41.32 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 116.47 -0.332 . . . . 4.79 110.855 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.459 ' HA ' HG12 ' A' ' 38' ' ' ILE . 77.2 m-85 -63.68 -44.1 94.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.463 -0.335 . . . . 0.43 111.014 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -57.95 -26.23 61.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.085 0.469 . . . . 2.79 111.75 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.46 -30.45 27.22 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.168 -0.469 . . . . 0.88 110.681 -176.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.459 HG12 ' HA ' ' A' ' 35' ' ' PHE . 33.9 pt -92.32 19.05 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 121.122 0.487 . . . . 1.25 112.06 -176.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.41 34.3 54.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.047 -0.597 . . . . 0.66 112.011 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -116.19 118.71 33.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 121.467 0.651 . . . . 1.67 112.162 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -85.82 151.14 24.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 106.939 -1.504 . . . . 1.06 106.939 172.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.404 ' O ' ' HG3' ' A' ' 46' ' ' MET . 32.7 p -55.0 -32.27 61.66 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.342 0.497 . . . . 1.52 112.342 176.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 tt -63.92 -50.08 70.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.659 -0.867 . . . . 2.24 108.659 176.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.56 -38.81 88.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.901 -0.59 . . . . 1.13 109.789 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.524 HD21 HG22 ' A' ' 68' ' ' VAL . 57.7 tp -61.72 -46.41 89.77 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.329 -0.851 . . . . 1.15 110.334 177.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 42' ' ' SER . 73.1 mtm -62.56 -37.39 85.97 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 116.456 -0.338 . . . . 2.13 111.278 177.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 29.8 tt0 -63.83 -35.47 80.74 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.539 0.685 . . . . 1.88 110.285 176.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.8 m -65.6 -53.25 44.35 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.227 -1.397 . . . . 1.18 107.227 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.402 ' HB3' HD13 ' A' ' 60' ' ' ILE . . . -56.83 -38.63 72.89 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.19 -1.368 . . . . 1.02 110.033 175.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.92 -44.99 91.43 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 123.96 0.904 . . . . 1.12 112.061 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.566 ' CZ ' ' HA ' ' A' ' 17' ' ' SER . 53.2 mtt180 -62.68 -38.78 91.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.701 -0.851 . . . . 3.59 108.701 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 96.6 mt -65.87 -41.18 91.92 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.041 -0.981 . . . . 1.61 111.212 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -55.7 -55.32 33.54 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.086 -0.709 . . . . 0.48 109.086 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.8 m -62.42 -51.24 68.31 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.534 -1.212 . . . . 1.75 112.433 -177.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -65.77 -38.09 88.11 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.037 0.754 . . . . 3.52 113.037 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -100.29 3.63 43.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 114.121 1.156 . . . . 1.35 114.121 -175.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.27 52.16 51.5 Favored Glycine 0 N--CA 1.459 0.193 0 N-CA-C 111.501 -0.64 . . . . 0.93 111.501 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.447 HG21 ' H ' ' A' ' 59' ' ' SER . 8.6 p -141.57 177.41 3.43 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 N-CA-C 107.853 -1.165 . . . . 1.72 107.853 -176.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.447 ' H ' HG21 ' A' ' 58' ' ' VAL . 10.8 t -141.55 155.61 45.77 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 119.271 0.942 . . . . 2.39 108.819 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 49' ' ' ALA . 73.4 mt -135.35 125.76 16.94 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 109.054 -0.721 . . . . 1.21 109.054 -176.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.13 124.84 16.85 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.115 2.543 . . . . 1.09 112.09 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.567 1.321 . . . . 1.83 114.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.564 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 15.3 t70 -71.03 -34.77 71.62 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.007 -0.677 . . . . 2.34 110.664 -176.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.39 -35.17 56.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.603 -0.888 . . . . 1.24 108.603 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -24.7 63.62 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.173 -0.921 . . . . 1.13 110.938 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.4 1.67 55.99 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.093 -0.575 . . . . 0.61 112.463 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 34.6 mmt180 -97.16 -17.58 19.81 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 122.243 -0.563 . . . . 4.72 110.3 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.524 HG22 HD21 ' A' ' 45' ' ' LEU . 30.6 m -76.43 109.94 11.16 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-O 122.045 0.926 . . . . 1.15 109.749 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -93.4 -30.83 14.89 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-N 115.033 -0.985 . . . . 1.91 109.224 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.9 p -118.76 136.0 23.99 Favored Pre-proline 0 N--CA 1.402 -2.841 0 CA-C-N 114.315 -1.311 . . . . 1.16 110.15 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.828 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 85.5 Cg_exo -50.58 -30.74 29.19 Favored 'Trans proline' 0 CA--C 1.51 -0.703 0 C-N-CA 124.218 3.279 . . . . 0.36 114.084 -178.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -51.72 -44.86 63.38 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 123.313 0.383 . . . . 1.84 110.891 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -67.89 -45.47 74.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 124.403 1.081 . . . . 2.13 110.03 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.49 HD21 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -66.62 -44.15 82.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.829 -1.078 . . . . 1.56 109.864 -176.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.14 -52.64 64.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.309 -0.626 . . . . 1.12 109.309 177.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.27 -44.68 75.85 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.14 0.976 . . . . 0.57 111.706 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.47 -52.05 67.26 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 115.028 -0.987 . . . . 2.48 110.219 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 52.1 mt -69.4 -39.25 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.774 -0.648 . . . . 1.19 110.282 -178.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -55.98 -46.31 78.68 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.32 0.248 . . . . 1.14 111.122 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.02 -43.85 96.64 Favored Glycine 0 N--CA 1.445 -0.762 0 O-C-N 123.832 0.707 . . . . 0.53 111.545 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.78 -38.21 73.4 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 122.652 0.381 . . . . 1.22 111.565 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.437 HD13 ' HG ' ' A' ' 5' ' ' LEU . 68.5 mt -66.55 -35.14 79.51 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 122.452 0.301 . . . . 1.97 111.794 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.745 0 CA-C-N 115.707 -0.679 . . . . 1.26 111.065 178.2 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.1 tp . . . . . 0 N--CA 1.396 -3.134 0 CA-C-O 121.383 0.611 . . . . 1.89 111.126 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.618 HD22 HD21 ' A' ' 52' ' ' LEU . 68.9 mt -91.57 124.28 35.61 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 124.025 0.93 . . . . 1.38 111.317 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.4 p -97.52 -177.81 3.93 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.276 -1.379 . . . . 1.29 107.276 170.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.649 HG23 ' HA ' ' A' ' 29' ' ' ASP . 8.5 m -58.19 -41.72 84.57 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 109.209 -0.663 . . . . 1.31 109.209 174.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -65.44 -43.04 91.68 Favored 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 115.609 -0.723 . . . . 1.65 112.071 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.407 ' HB3' HD23 ' A' ' 5' ' ' LEU . 12.3 m-20 -64.91 -39.65 93.85 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.577 -0.527 . . . . 1.41 109.577 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.58 HD11 HD11 ' A' ' 74' ' ' LEU . 20.0 tp -65.4 -56.26 13.54 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 114.785 -1.098 . . . . 1.23 109.424 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -49.18 -47.97 45.5 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.693 1.197 . . . . 3.04 111.18 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -56.65 -46.16 81.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.853 -1.067 . . . . 4.47 111.154 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.67 77.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.466 -0.788 . . . . 1.19 111.736 -176.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.406 HD11 HG23 ' A' ' 48' ' ' THR . 4.0 mm? -63.74 -57.16 10.82 Favored 'General case' 0 C--O 1.246 0.895 0 N-CA-C 109.298 -0.63 . . . . 2.05 109.298 175.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -54.48 -50.34 58.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-N 114.916 -1.038 . . . . 1.33 111.317 -175.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -61.05 -30.07 70.11 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.268 0.47 . . . . 2.05 112.268 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 C--N 1.318 -0.799 0 CA-C-O 121.041 0.448 . . . . 1.66 112.065 -177.718 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.649 ' HA ' HG23 ' A' ' 7' ' ' THR . 8.4 m-20 . . . . . 0 CA--C 1.489 -1.398 0 N-CA-C 108.73 -0.841 . . . . 2.07 108.73 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -94.34 18.94 10.21 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.373 -0.831 . . . . 0.51 111.436 -174.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.716 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 63.4 mt -53.7 -24.93 16.2 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.197 1.184 . . . . 1.12 114.197 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.18 -19.56 19.96 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.22 0.533 . . . . 2.04 110.812 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.8 mt -80.36 128.34 33.44 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.715 -0.675 . . . . 2.01 109.887 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.72 155.37 35.69 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.126 -0.488 . . . . 4.79 109.996 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.405 ' HA ' HG12 ' A' ' 38' ' ' ILE . 81.8 m-85 -67.1 -44.14 80.75 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 120.872 -0.331 . . . . 0.43 110.432 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.2 -24.64 64.97 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.6 0.714 . . . . 2.79 110.533 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.78 -30.73 40.76 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.462 -0.79 . . . . 0.88 110.057 -177.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.5 pt -98.33 13.11 4.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 112.126 0.417 . . . . 1.25 112.126 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.02 48.96 18.22 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 115.881 -0.599 . . . . 0.66 112.91 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -134.37 118.33 17.33 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.699 0.629 . . . . 1.67 112.699 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -91.04 161.52 15.09 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.073 -0.512 . . . . 1.06 109.888 172.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.496 ' O ' ' HG3' ' A' ' 46' ' ' MET . 56.0 p -54.98 -29.44 56.99 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.476 1.287 . . . . 1.52 114.476 -179.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.11 -50.82 64.58 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 117.991 0.36 . . . . 2.24 110.424 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.98 86.71 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.68 0.752 . . . . 1.13 109.637 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.664 ' O ' ' HB ' ' A' ' 48' ' ' THR . 29.8 tp -63.87 -40.63 97.0 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.706 -1.134 . . . . 1.15 110.989 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.5 mtm -64.58 -37.06 86.26 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 121.774 -0.579 . . . . 2.13 112.02 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.73 -28.58 68.54 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.103 0.954 . . . . 1.88 109.829 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.664 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 62.5 m -64.89 -53.84 40.18 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.57 -1.641 . . . . 1.18 106.57 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.489 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.49 -36.21 68.87 Favored 'General case' 0 C--O 1.205 -1.287 0 CA-C-N 114.341 -1.299 . . . . 1.02 110.041 174.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.77 -40.76 80.53 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 122.917 0.487 . . . . 1.12 112.032 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.1 mtp85 -64.79 -39.3 93.37 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.654 0.74 . . . . 3.59 109.159 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.618 HD21 HD22 ' A' ' 5' ' ' LEU . 64.4 mt -65.27 -44.67 87.28 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.429 -1.26 . . . . 1.61 109.413 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 42.8 mt-10 -55.97 -50.55 70.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.541 -0.754 . . . . 0.48 110.227 176.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.1 m -62.99 -49.55 74.26 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.659 -0.701 . . . . 1.75 112.025 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -63.68 -44.06 94.83 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.446 0.536 . . . . 3.52 112.446 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -94.65 -7.45 40.8 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.08 0.77 . . . . 1.35 113.08 -173.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 69.39 51.54 26.25 Favored Glycine 0 C--O 1.24 0.483 0 N-CA-C 111.298 -0.721 . . . . 0.93 111.298 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.0 p -141.3 176.86 4.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 N-CA-C 107.62 -1.252 . . . . 1.72 107.62 -176.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.7 t -139.06 132.23 29.78 Favored 'General case' 0 N--CA 1.424 -1.755 0 N-CA-C 108.433 -0.951 . . . . 2.39 108.433 174.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.442 HD11 ' HB1' ' A' ' 49' ' ' ALA . 67.0 mt -104.59 123.14 41.25 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.003 -0.999 . . . . 1.21 108.933 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.505 ' HB2' HG22 ' A' ' 64' ' ' VAL . 36.9 Cg_exo -58.79 118.28 5.14 Favored 'Trans proline' 0 C--O 1.25 1.11 0 C-N-CA 122.373 2.049 . . . . 1.09 110.413 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.92 -26.87 38.94 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.699 0.799 . . . . 1.83 112.759 -176.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.96 -28.92 65.95 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 116.114 -0.493 . . . . 2.34 110.749 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.505 HG22 ' HB2' ' A' ' 61' ' ' PRO . 67.2 t -76.99 -48.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 N-CA-C 108.509 -0.923 . . . . 1.24 108.509 177.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.66 -30.74 63.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.955 -1.02 . . . . 1.13 112.097 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -89.15 -5.19 73.41 Favored Glycine 0 N--CA 1.439 -1.127 0 C-N-CA 120.051 -1.071 . . . . 0.61 113.009 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -98.53 -14.99 19.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.97 0.73 . . . . 4.72 112.97 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.497 HG22 HD23 ' A' ' 74' ' ' LEU . 26.7 m -79.66 121.56 33.18 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 CA-C-O 121.09 0.472 . . . . 1.15 110.933 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -93.16 -39.08 11.23 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.629 0.728 . . . . 1.91 110.911 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.421 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 34.9 p -115.42 138.47 23.73 Favored Pre-proline 0 N--CA 1.413 -2.316 0 CA-C-N 115.369 -0.832 . . . . 1.16 110.739 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.716 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 74.1 Cg_exo -52.75 -29.73 43.56 Favored 'Trans proline' 0 CA--C 1.508 -0.787 0 C-N-CA 124.34 3.36 . . . . 0.36 113.729 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -51.36 -44.93 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 123.439 0.462 . . . . 1.84 110.581 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.408 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 31.8 mt-10 -66.82 -49.28 66.29 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 123.982 0.913 . . . . 2.13 109.786 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.58 HD11 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -64.71 -43.61 92.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.743 -1.117 . . . . 1.56 110.193 -175.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 43.9 tp -57.28 -56.96 15.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 123.667 0.604 . . . . 1.12 109.98 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.66 -45.03 93.25 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 112.888 0.699 . . . . 0.57 112.888 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 73' ' ' GLU . 87.0 mt -61.77 -37.66 85.14 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 112.115 0.413 . . . . 2.48 112.115 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 64.7 mt -80.72 -35.57 14.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 C-N-CA 120.23 -0.588 . . . . 1.19 109.977 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -57.74 -40.94 80.84 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 110.383 -0.228 . . . . 1.14 110.383 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.61 -40.8 99.22 Favored Glycine 0 N--CA 1.45 -0.375 0 O-C-N 123.613 0.57 . . . . 0.53 112.033 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.27 -30.79 68.98 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.179 0.514 . . . . 1.22 110.458 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 86.6 mt -77.19 -34.19 56.26 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.719 -0.673 . . . . 1.97 110.444 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.684 0 CA-C-O 121.237 0.542 . . . . 1.26 110.777 177.054 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.3 mp . . . . . 0 C--O 1.25 1.081 0 N-CA-C 115.012 1.486 . . . . 1.89 115.012 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.475 HD13 HD21 ' A' ' 52' ' ' LEU . 82.3 mt -113.86 132.9 55.73 Favored 'General case' 0 CA--C 1.491 -1.319 0 CA-C-N 113.718 -1.583 . . . . 1.38 108.431 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.8 p -99.8 -174.78 2.79 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 108.909 -0.775 . . . . 1.29 108.909 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -57.75 -45.81 85.38 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.418 0.627 . . . . 1.31 109.31 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -61.18 -42.35 98.42 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 114.789 -1.096 . . . . 1.65 110.636 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.83 -40.73 88.1 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 115.666 -0.697 . . . . 1.41 111.413 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.412 HD13 HD13 ' A' ' 74' ' ' LEU . 15.9 tp -63.85 -38.44 91.1 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.539 -0.755 . . . . 1.23 109.31 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.515 ' O ' HG23 ' A' ' 15' ' ' VAL . 39.8 ttm105 -56.12 -54.35 46.17 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.526 -0.761 . . . . 3.04 109.998 173.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 8.6 tpt180 -57.43 -34.68 69.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 115.645 -0.707 . . . . 4.47 111.379 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.96 75.46 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.289 0.368 . . . . 1.19 110.275 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.444 ' O ' ' OH ' ' A' ' 40' ' ' TYR . 10.6 mp -67.02 -24.28 66.0 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.116 0.413 . . . . 2.05 112.116 177.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 11' ' ' ARG . 97.2 t -68.46 -45.99 81.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.979 -0.749 . . . . 1.33 108.979 175.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 14.4 mm-40 -62.66 -44.95 94.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.698 -0.683 . . . . 2.05 112.829 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.559 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 3.9 p . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 112.64 0.608 . . . . 1.66 112.64 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 N--CA 1.444 -0.745 0 N-CA-C 108.551 -0.907 . . . . 2.07 108.551 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.432 ' HB2' HD12 ' A' ' 33' ' ' LEU . 18.6 p90 -126.48 20.33 7.31 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.896 -0.593 . . . . 0.51 109.947 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.74 ' HB3' ' HB2' ' A' ' 72' ' ' ARG . 22.2 mt -53.85 -31.31 49.02 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.144 1.164 . . . . 1.12 114.144 -178.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -95.63 -6.63 39.71 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.94 0.4 . . . . 2.04 111.24 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.432 HD12 ' HB2' ' A' ' 30' ' ' PHE . 65.0 mt -82.18 109.96 16.95 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 106.796 -1.557 . . . . 2.01 106.796 176.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HD2' ' OD1' ' A' ' 69' ' ' ASP . 32.5 mtm105 -72.08 152.77 42.13 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.457 -0.571 . . . . 4.79 109.457 -173.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.63 -46.75 86.83 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.567 -0.531 . . . . 0.43 109.567 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -57.98 -23.28 53.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.814 0.446 . . . . 2.79 111.956 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -83.14 -28.74 29.19 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.165 0.507 . . . . 0.88 110.702 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.4 pt -97.24 13.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.303 0.573 . . . . 1.25 112.097 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.24 32.17 32.35 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.928 -0.653 . . . . 0.66 112.774 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.444 ' OH ' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-85 -115.97 105.48 12.7 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.169 0.509 . . . . 1.67 111.388 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -83.3 158.6 22.15 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.766 -1.198 . . . . 1.06 107.766 176.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.624 ' O ' ' HG3' ' A' ' 46' ' ' MET . 53.5 p -52.19 -31.08 30.0 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.377 0.88 . . . . 1.52 113.377 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.1 -51.32 64.57 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 120.982 0.42 . . . . 2.24 110.069 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.32 84.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.386 0.612 . . . . 1.13 109.886 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.473 HD23 HG21 ' A' ' 68' ' ' VAL . 52.9 tp -61.88 -45.44 93.75 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 1.15 110.717 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 42' ' ' SER . 54.0 mtt -62.81 -39.32 93.91 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 110.247 -0.279 . . . . 2.13 110.247 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -62.37 -37.64 86.48 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.768 0.795 . . . . 1.88 108.921 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.422 HG22 HD12 ' A' ' 14' ' ' LEU . 83.8 m -67.99 -57.63 5.85 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.502 -1.227 . . . . 1.18 108.082 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.476 ' HA ' HD13 ' A' ' 52' ' ' LEU . . . -57.06 -32.38 66.17 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 114.532 -1.213 . . . . 1.02 111.033 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.58 83.61 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.477 0.711 . . . . 1.12 111.721 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.559 ' NH2' ' HA ' ' A' ' 17' ' ' SER . 75.0 mtt180 -66.53 -39.9 88.85 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.84 -1.073 . . . . 3.59 109.064 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.476 HD13 ' HA ' ' A' ' 49' ' ' ALA . 90.3 mt -64.86 -40.56 95.35 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.143 -0.935 . . . . 1.61 110.029 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -56.3 -55.29 35.14 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.66 -0.7 . . . . 0.48 109.641 174.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.0 t -63.14 -44.38 95.69 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 115.096 -0.957 . . . . 1.75 111.731 -176.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.13 -49.6 71.51 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.817 0.673 . . . . 3.52 112.817 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -94.13 -6.72 44.29 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 114.35 1.241 . . . . 1.35 114.35 -172.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.64 52.88 6.89 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.779 -1.2 . . . . 0.93 111.301 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.538 ' HB ' HD11 ' A' ' 82' ' ' LEU . 12.0 p -138.95 176.9 5.53 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 106.352 -1.721 . . . . 1.72 106.352 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.479 ' H ' HG23 ' A' ' 58' ' ' VAL . 17.1 t -141.7 145.08 34.46 Favored 'General case' 0 N--CA 1.415 -2.198 0 N-CA-C 108.712 -0.847 . . . . 2.39 108.712 177.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.472 HD11 ' HB1' ' A' ' 49' ' ' ALA . 64.4 mt -131.97 111.37 14.5 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.451 -1.314 . . . . 1.21 107.451 -178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.457 ' HB2' HG22 ' A' ' 64' ' ' VAL . 37.5 Cg_exo -62.02 128.97 25.67 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.7 2.267 . . . . 1.09 111.039 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.425 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 9.4 p-10 -55.06 -30.06 58.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.393 1.077 . . . . 1.83 112.48 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -68.36 -35.76 78.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.334 -0.617 . . . . 2.34 109.334 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.457 HG22 ' HB2' ' A' ' 61' ' ' PRO . 25.3 t -76.88 -47.68 27.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 108.382 -0.97 . . . . 1.24 108.382 176.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.15 -29.32 63.52 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 123.516 0.727 . . . . 1.13 112.509 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.445 ' HA2' ' HB2' ' A' ' 42' ' ' SER . . . -85.55 -2.51 87.07 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.66 -0.781 . . . . 0.61 112.953 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -100.18 -24.62 14.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.639 0.219 . . . . 4.72 111.341 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.473 HG21 HD23 ' A' ' 45' ' ' LEU . 12.3 m -73.61 120.4 22.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.975 0.893 . . . . 1.15 111.728 -175.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 28.4 t70 -91.59 -47.48 7.38 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-N 114.233 -1.349 . . . . 1.91 112.386 -175.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 41.1 p -107.85 143.18 26.79 Favored Pre-proline 0 N--CA 1.408 -2.56 0 CA-C-N 116.014 -0.539 . . . . 1.16 110.91 -177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.607 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 79.5 Cg_exo -53.74 -31.24 60.22 Favored 'Trans proline' 0 C--O 1.211 -0.839 0 C-N-CA 123.655 2.903 . . . . 0.36 111.706 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.74 ' HB2' ' HB3' ' A' ' 31' ' ' LEU . 25.0 ttp85 -51.4 -53.33 37.75 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 123.761 0.663 . . . . 1.84 111.03 174.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.84 -39.78 87.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.25 -0.432 . . . . 2.13 111.049 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.425 HD22 HG23 ' A' ' 68' ' ' VAL . 3.1 tm? -68.16 -44.85 75.05 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.406 -0.361 . . . . 1.56 111.207 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.2 tp -56.99 -50.06 73.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.22 -0.659 . . . . 1.12 109.22 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.54 -37.71 88.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.179 -0.918 . . . . 0.57 111.635 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.437 HD12 HG12 ' A' ' 64' ' ' VAL . 5.1 tt -58.3 -52.35 65.97 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 108.835 -0.802 . . . . 2.48 108.835 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.5 mt -64.56 -50.7 74.71 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 N-CA-C 109.131 -0.692 . . . . 1.19 109.131 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -51.2 -44.05 61.5 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.547 0.53 . . . . 1.14 111.871 -178.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.55 -48.73 48.79 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 121.237 -0.506 . . . . 0.53 112.456 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.92 79.41 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.122 0.487 . . . . 1.22 111.276 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.538 HD11 ' HB ' ' A' ' 58' ' ' VAL . 17.5 tp -70.95 -33.32 70.37 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.707 -0.679 . . . . 1.97 110.248 -177.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.655 0 CA-C-O 120.899 0.38 . . . . 1.26 111.212 175.401 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.4 tp . . . . . 0 N--CA 1.409 -2.519 0 N-CA-C 109.564 -0.532 . . . . 1.89 109.564 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.37 124.58 48.19 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.318 -0.623 . . . . 1.38 109.318 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.7 p -104.26 -170.82 1.82 Allowed 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.727 -1.212 . . . . 1.29 107.727 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.794 HG22 ' HA ' ' A' ' 29' ' ' ASP . 27.9 m -56.07 -49.55 73.48 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.152 0.501 . . . . 1.31 110.035 177.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.32 -43.3 88.12 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 114.89 -1.05 . . . . 1.65 110.267 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.13 -43.2 78.87 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.594 -0.73 . . . . 1.41 110.814 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.57 HD11 HD12 ' A' ' 74' ' ' LEU . 14.3 tp -65.19 -38.16 89.59 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.121 -0.945 . . . . 1.23 109.946 -175.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.495 ' O ' HG23 ' A' ' 15' ' ' VAL . 36.8 ttp180 -51.01 -52.65 40.8 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.203 -0.908 . . . . 3.04 110.39 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.62 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 79.0 ttt180 -57.69 -42.77 84.34 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.021 -0.536 . . . . 4.47 111.982 -177.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.21 84.66 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.151 0.282 . . . . 1.19 110.663 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.586 HD22 HG22 ' A' ' 48' ' ' THR . 97.2 mt -65.85 -41.73 91.35 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.941 -0.572 . . . . 2.05 110.17 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 11' ' ' ARG . 57.3 t -61.59 -49.97 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.198 0.599 . . . . 1.33 110.111 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 48.1 mm-40 -57.35 -45.43 84.35 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.728 -0.669 . . . . 2.05 109.845 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.506 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.8 m . . . . . 0 C--N 1.312 -1.023 0 CA-C-N 115.456 -0.793 . . . . 1.66 112.547 -175.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.794 ' HA ' HG22 ' A' ' 7' ' ' THR . 29.0 t70 . . . . . 0 CA--C 1.507 -0.704 0 N-CA-C 108.898 -0.778 . . . . 2.07 108.898 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -121.86 22.2 10.47 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.96 -0.564 . . . . 0.51 111.142 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.47 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 55.6 mt -52.55 -19.47 2.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.417 1.636 . . . . 1.12 115.417 -177.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -92.97 -19.7 21.35 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.403 0.144 . . . . 2.04 111.345 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.23 122.22 26.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 2.01 110.281 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.513 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 34.6 mtm105 -77.8 145.85 36.14 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.962 -0.563 . . . . 4.79 109.798 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.586 ' HA ' HG12 ' A' ' 38' ' ' ILE . 46.6 m-85 -61.97 -42.08 98.73 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.582 -0.281 . . . . 0.43 110.795 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.94 -38.59 70.53 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.381 0.61 . . . . 2.79 110.24 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.11 -22.55 42.02 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.43 -0.805 . . . . 0.88 111.069 -173.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.586 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.6 pt -92.3 13.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.751 0.786 . . . . 1.25 110.55 177.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.91 87.5 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.571 -0.74 . . . . 0.66 113.81 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -81.83 131.86 35.27 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 112.189 0.441 . . . . 1.67 112.189 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.14 142.46 30.34 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.216 -1.772 . . . . 1.06 106.216 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 46' ' ' MET . 33.7 p -54.12 -31.98 53.76 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.522 0.934 . . . . 1.52 113.522 179.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.2 tp -64.68 -42.1 95.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.89 0.376 . . . . 2.24 110.234 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.62 -36.37 84.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.506 0.669 . . . . 1.13 109.709 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.496 HD21 HG22 ' A' ' 68' ' ' VAL . 54.7 tp -63.92 -45.23 90.2 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.205 -0.907 . . . . 1.15 109.931 176.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 42' ' ' SER . 83.3 mtp -61.89 -38.28 87.75 Favored 'General case' 0 C--O 1.196 -1.714 0 CA-C-N 115.931 -0.577 . . . . 2.13 110.258 176.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.463 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.8 tp10 -60.96 -35.2 76.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.806 0.842 . . . . 1.88 109.871 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.586 HG22 HD22 ' A' ' 14' ' ' LEU . 87.3 m -66.61 -57.33 7.44 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.566 -1.272 . . . . 1.18 107.566 -178.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.516 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.12 -43.61 74.26 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 113.725 -1.58 . . . . 1.02 109.567 177.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.07 91.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.75 0.82 . . . . 1.12 113.038 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 84.1 mtt180 -66.47 -38.27 86.96 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.23 -0.441 . . . . 3.59 109.989 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.62 -38.05 89.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.872 -0.604 . . . . 1.61 109.926 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -57.29 -55.12 38.83 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.642 -0.503 . . . . 0.48 109.642 173.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 59.2 p -61.19 -38.06 85.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.679 0.612 . . . . 1.75 112.504 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -71.01 -46.27 62.48 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.63 0.974 . . . . 3.52 113.63 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -101.74 -13.97 17.53 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 114.697 1.369 . . . . 1.35 114.697 -172.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.5 40.32 Favored Glycine 0 C--N 1.308 -0.986 0 C-N-CA 120.099 -1.048 . . . . 0.93 110.885 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 4.1 p -97.09 135.31 31.68 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 N-CA-C 109.126 -0.694 . . . . 1.72 109.126 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 m -96.77 106.07 18.3 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 109.92 -0.4 . . . . 2.39 109.92 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.9 mt -102.19 117.45 61.25 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 110.362 -0.236 . . . . 1.21 110.362 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.78 131.21 26.78 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.222 1.948 . . . . 1.09 110.329 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -51.88 -34.1 39.62 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.634 0.976 . . . . 1.83 113.634 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.615 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 3.4 m-20 -66.44 -45.62 79.22 Favored 'General case' 0 CA--C 1.495 -1.15 0 CA-C-O 120.566 0.222 . . . . 2.34 110.777 -178.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.5 t -71.27 -31.68 44.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.538 -0.542 . . . . 1.24 109.538 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.82 -22.51 58.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.911 -0.586 . . . . 1.13 112.228 177.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.61 0.84 27.65 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 120.553 -0.832 . . . . 0.61 111.923 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.615 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 4.6 mmp_? -96.41 -15.11 21.98 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.185 -0.672 . . . . 4.72 109.185 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.507 HG21 HD23 ' A' ' 74' ' ' LEU . 19.5 m -76.85 91.84 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 CA-C-O 122.559 1.171 . . . . 1.15 109.641 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.513 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 18.9 t70 -86.23 -35.57 19.94 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 114.417 -1.265 . . . . 1.91 111.375 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.404 HG23 ' HG2' ' A' ' 34' ' ' ARG . 45.0 p -113.75 149.17 41.33 Favored Pre-proline 0 C--N 1.284 -2.255 0 N-CA-C 109.355 -0.609 . . . . 1.16 109.355 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.47 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.6 Cg_exo -52.27 -39.99 71.01 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.561 2.841 . . . . 0.36 112.949 -178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.9 ptp85 -50.86 -40.94 57.42 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 123.715 0.634 . . . . 1.84 112.52 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.01 -52.6 58.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.059 0.457 . . . . 2.13 110.802 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.57 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -67.86 -42.05 81.94 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.083 -0.962 . . . . 1.56 109.99 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.9 tp -56.41 -57.02 14.08 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.524 -0.762 . . . . 1.12 109.321 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.73 -39.2 80.17 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.926 -0.579 . . . . 0.57 112.253 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.04 -46.45 89.49 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.214 0.53 . . . . 2.48 109.633 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.44 -36.73 20.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-N 116.069 -0.514 . . . . 1.19 110.292 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -56.96 -47.03 81.69 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.223 0.209 . . . . 1.14 110.95 177.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.53 -39.68 97.67 Favored Glycine 0 N--CA 1.447 -0.592 0 O-C-N 123.552 0.533 . . . . 0.53 112.155 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.37 75.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.023 0.44 . . . . 1.22 110.518 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.9 mt -68.24 -33.97 75.36 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.97 -0.559 . . . . 1.97 110.691 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 123.428 0.691 . . . . 1.26 111.917 179.327 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.441 -0.876 0 N-CA-C 112.641 0.608 . . . . 1.89 112.641 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.481 HD23 ' OD1' ' A' ' 9' ' ' ASP . 88.3 mt -126.52 147.45 49.84 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 108.672 -0.862 . . . . 1.38 108.672 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.8 p -99.43 172.78 7.11 Favored 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 107.372 -1.344 . . . . 1.29 107.372 174.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.693 HG21 ' HA ' ' A' ' 29' ' ' ASP . 21.0 m -58.9 -31.25 68.44 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.278 -0.638 . . . . 1.31 109.278 172.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -66.02 -50.68 63.37 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.356 -0.838 . . . . 1.65 111.716 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.481 ' OD1' HD23 ' A' ' 5' ' ' LEU . 15.4 t70 -68.44 -37.8 80.57 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.347 -0.541 . . . . 1.41 109.909 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.507 HD22 ' HB2' ' A' ' 75' ' ' LEU . 18.4 tp -62.67 -42.95 99.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.28 -0.873 . . . . 1.23 108.984 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.517 ' O ' HG21 ' A' ' 15' ' ' VAL . 42.2 ttp180 -50.35 -38.19 40.83 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 124.507 1.123 . . . . 3.04 111.12 178.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.668 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 59.6 ttt180 -56.25 -51.39 68.28 Favored 'General case' 0 C--O 1.216 -0.665 0 O-C-N 123.592 0.557 . . . . 4.47 110.724 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.45 -37.17 84.85 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 123.379 0.424 . . . . 1.19 111.909 -174.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.489 HD11 HG23 ' A' ' 48' ' ' THR . 3.8 mm? -66.84 -29.66 69.64 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.312 -0.404 . . . . 2.05 111.296 176.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.517 HG21 ' O ' ' A' ' 11' ' ' ARG . 61.8 t -77.67 -39.97 27.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.401 -0.592 . . . . 1.33 109.401 176.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.668 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 6.7 mm-40 -55.99 -53.18 60.01 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.015 0.926 . . . . 2.05 110.655 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 115.552 -0.749 . . . . 1.66 111.866 -174.713 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.693 ' HA ' HG21 ' A' ' 7' ' ' THR . 12.0 t70 . . . . . 0 CA--C 1.496 -1.122 0 N-CA-C 108.049 -1.093 . . . . 2.07 108.049 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.415 ' CZ ' ' HG ' ' A' ' 14' ' ' LEU . 11.8 p90 -137.66 20.13 2.89 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.793 -0.363 . . . . 0.51 110.177 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.73 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 75.7 mt -54.98 -22.42 15.19 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.15 0.796 . . . . 1.12 113.15 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -92.12 -14.59 28.94 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.733 0.813 . . . . 2.04 111.0 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -80.11 131.77 35.81 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 115.891 -0.595 . . . . 2.01 109.978 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.628 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 14.3 mmt180 -76.65 137.56 39.51 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.371 -0.603 . . . . 4.79 109.371 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 40' ' ' TYR . 47.2 m-85 -62.76 -37.72 87.74 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 107.638 -1.245 . . . . 0.43 107.638 175.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -55.45 -33.92 64.03 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.418 -1.265 . . . . 2.79 110.332 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.3 -35.08 28.34 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 115.983 -0.553 . . . . 0.88 110.617 -176.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.498 HG12 ' HA ' ' A' ' 35' ' ' PHE . 38.0 pt -90.44 16.14 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.404 -0.518 . . . . 1.25 111.042 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 28.74 73.91 Favored Glycine 0 C--O 1.238 0.39 0 CA-C-N 115.341 -0.845 . . . . 0.66 113.236 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.631 ' HB3' ' HB3' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -97.37 114.03 25.78 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 109.469 -0.567 . . . . 1.67 109.469 -177.694 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.11 149.98 25.17 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 116.053 -0.521 . . . . 1.06 110.547 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 77.6 p -50.74 -33.94 25.09 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.916 1.08 . . . . 1.52 113.916 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.31 -49.42 69.55 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.841 -0.8 . . . . 2.24 108.841 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.07 -37.91 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.723 -0.671 . . . . 1.13 109.838 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.626 HD22 HG22 ' A' ' 68' ' ' VAL . 63.5 tp -62.95 -46.39 87.97 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.393 -0.821 . . . . 1.15 110.994 177.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 67.6 mtt -63.05 -36.56 83.99 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 110.168 -0.308 . . . . 2.13 110.168 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 37.9 tt0 -64.55 -31.26 72.4 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.501 0.667 . . . . 1.88 110.831 176.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.518 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 96.8 m -66.06 -55.49 16.29 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.462 -1.31 . . . . 1.18 107.462 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.46 ' HB3' HD11 ' A' ' 60' ' ' ILE . . . -56.71 -38.63 72.59 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 113.909 -1.496 . . . . 1.02 109.795 175.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.8 78.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.486 0.714 . . . . 1.12 111.63 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 71.3 mtt180 -63.67 -39.38 94.2 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.365 -0.834 . . . . 3.59 109.933 179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 59.2 mt -65.36 -41.96 93.27 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.068 0.396 . . . . 1.61 112.068 176.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.8 mt-10 -57.59 -48.62 78.9 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 122.325 0.25 . . . . 0.48 110.544 175.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -63.43 -44.51 94.36 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.389 0.614 . . . . 1.75 111.428 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -65.99 -44.12 85.78 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.154 -0.93 . . . . 3.52 112.844 -176.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -101.57 -18.59 15.85 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 115.296 1.591 . . . . 1.35 115.296 -177.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.84 62.37 1.77 Allowed Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.257 -0.973 . . . . 0.93 111.434 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.1 m -139.21 177.77 4.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 C-N-CA 123.523 0.729 . . . . 1.72 110.125 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -140.22 115.95 10.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 123.632 0.583 . . . . 2.39 109.855 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.46 HD11 ' HB3' ' A' ' 49' ' ' ALA . 86.4 mt -101.01 130.31 25.34 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.461 -0.79 . . . . 1.21 110.294 -177.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.93 126.75 22.02 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.781 2.321 . . . . 1.09 111.647 176.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -51.35 -54.01 30.64 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.854 1.262 . . . . 1.83 113.658 -173.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.11 -28.45 63.29 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 116.235 -0.439 . . . . 2.34 111.66 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.79 -37.62 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.462 -0.94 . . . . 1.24 108.462 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.93 -24.99 60.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.105 -0.952 . . . . 1.13 111.377 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.56 11.98 39.16 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 121.057 -0.592 . . . . 0.61 112.618 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -105.23 -21.62 13.22 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.378 0.608 . . . . 4.72 110.535 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.626 HG22 HD22 ' A' ' 45' ' ' LEU . 28.6 m -76.64 115.67 18.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 121.597 0.713 . . . . 1.15 111.286 -176.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.628 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 33.3 t70 -97.79 -23.76 15.75 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 121.62 0.724 . . . . 1.91 110.533 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 70.7 p -116.75 143.97 32.45 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.512 -0.767 . . . . 1.16 110.897 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.73 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 39.4 Cg_exo -59.36 -30.82 93.74 Favored 'Trans proline' 0 C--O 1.204 -1.204 0 C-N-CA 123.308 2.672 . . . . 0.36 112.352 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.539 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 6.0 ptp180 -54.75 -44.78 73.91 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.12 -0.232 . . . . 1.84 111.329 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.2 -46.19 81.71 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.197 0.522 . . . . 2.13 109.829 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.454 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.1 -45.13 82.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.263 -0.881 . . . . 1.56 110.553 -176.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.507 ' HB2' HD22 ' A' ' 10' ' ' LEU . 61.8 tp -57.2 -54.19 49.59 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 109.454 -0.573 . . . . 1.12 109.454 176.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -59.99 -37.73 80.54 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 123.908 0.755 . . . . 0.57 111.804 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.92 -50.1 74.78 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 122.925 0.49 . . . . 2.48 110.522 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.8 mt -70.41 -31.13 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.566 -0.531 . . . . 1.19 109.566 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -39.61 93.62 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-N 116.067 -0.515 . . . . 1.14 109.647 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.58 -38.9 93.7 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.857 -0.497 . . . . 0.53 111.857 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.84 -37.89 79.44 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.23 0.538 . . . . 1.22 110.194 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.7 mt -74.93 -20.92 59.49 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.908 -0.587 . . . . 1.97 111.117 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 121.027 0.441 . . . . 1.26 110.536 174.306 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.7 tp . . . . . 0 N--CA 1.411 -2.391 0 CA-C-O 121.237 0.541 . . . . 1.89 111.398 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.6 ' HG ' HD13 ' A' ' 82' ' ' LEU . 79.8 mt -98.5 129.07 45.08 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 115.091 -0.959 . . . . 1.38 108.42 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -96.6 -171.97 2.39 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 107.144 -1.428 . . . . 1.29 107.144 173.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 m -56.73 -38.91 73.03 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.265 0.555 . . . . 1.31 110.218 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.79 -41.1 60.63 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 111.367 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.94 -36.03 83.07 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.896 -0.779 . . . . 1.41 108.896 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.465 HD11 ' CD1' ' A' ' 74' ' ' LEU . 19.7 tp -66.21 -50.88 62.32 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.829 -1.078 . . . . 1.23 108.474 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.409 ' O ' HG21 ' A' ' 15' ' ' VAL . 11.9 ttp180 -50.33 -42.13 52.38 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.82 0.7 . . . . 3.04 111.509 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -53.21 -47.04 69.25 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.727 0.642 . . . . 4.47 110.325 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.539 ' HB1' HD21 ' A' ' 52' ' ' LEU . . . -66.06 -42.83 88.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.696 -0.684 . . . . 1.19 112.085 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.612 HD11 HG22 ' A' ' 48' ' ' THR . 4.1 mm? -64.08 -34.79 78.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.008 0.433 . . . . 2.05 111.157 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 11' ' ' ARG . 95.1 t -69.55 -25.03 27.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 120.997 0.427 . . . . 1.33 111.499 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.44 ' OE1' ' HA ' ' A' ' 16' ' ' GLU . 5.6 mm-40 -63.35 -45.96 88.76 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.174 0.511 . . . . 2.05 111.822 177.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 p . . . . . 0 C--N 1.315 -0.923 0 CA-C-O 121.443 0.64 . . . . 1.66 110.919 -179.588 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 CA--C 1.51 -0.59 0 N-CA-C 108.939 -0.763 . . . . 2.07 108.939 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -133.52 14.73 4.08 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.104 -0.638 . . . . 0.51 111.17 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 42.4 mt -52.86 -31.96 42.21 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 114.071 1.137 . . . . 1.12 114.071 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -94.29 -7.42 41.98 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 116.276 -0.42 . . . . 2.04 111.86 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mp -84.84 123.58 30.62 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.741 -1.207 . . . . 2.01 107.741 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -73.95 145.65 44.53 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 109.71 -0.478 . . . . 4.79 109.71 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.515 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 51.9 m-85 -61.49 -36.42 80.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.368 -0.605 . . . . 0.43 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -56.28 -36.78 68.99 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.318 -0.856 . . . . 2.79 110.726 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.9 -35.43 37.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.837 -0.62 . . . . 0.88 110.141 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -93.27 12.91 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 113.267 0.84 . . . . 1.25 113.267 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.49 41.11 30.91 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.051 -0.595 . . . . 0.66 114.27 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.515 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 13.7 m-85 -116.95 110.23 18.03 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 122.625 0.37 . . . . 1.67 110.724 176.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -88.46 155.09 19.86 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 120.562 -0.455 . . . . 1.06 110.313 174.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 46' ' ' MET . 79.4 p -51.94 -33.42 37.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.315 1.228 . . . . 1.52 114.315 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.26 -51.78 58.61 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.886 -0.413 . . . . 2.24 109.886 -178.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.49 89.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.498 0.666 . . . . 1.13 110.058 175.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.517 ' O ' ' HB ' ' A' ' 48' ' ' THR . 60.0 tp -62.37 -47.55 83.66 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.138 -0.937 . . . . 1.15 110.945 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.418 ' HG3' ' O ' ' A' ' 42' ' ' SER . 62.1 mtm -63.87 -37.23 86.61 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 122.443 -0.161 . . . . 2.13 110.796 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.627 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 40.2 tt0 -62.2 -31.43 71.95 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.49 0.662 . . . . 1.88 109.912 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.612 HG22 HD11 ' A' ' 14' ' ' LEU . 65.2 m -66.67 -56.9 8.49 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.591 -1.263 . . . . 1.18 107.591 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 60' ' ' ILE . . . -57.34 -35.48 69.95 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 114.384 -1.28 . . . . 1.02 110.553 176.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.47 -44.05 84.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.411 0.684 . . . . 1.12 111.933 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.627 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 44.2 mtt180 -64.78 -37.12 86.54 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.303 -0.862 . . . . 3.59 109.412 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.539 HD21 ' HB1' ' A' ' 13' ' ' ALA . 98.2 mt -67.62 -45.86 74.21 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.21 -0.905 . . . . 1.61 111.286 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.2 mt-10 -54.43 -51.99 63.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 123.093 0.557 . . . . 0.48 110.214 178.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 m -61.91 -48.85 78.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 114.943 -1.026 . . . . 1.75 111.829 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 55' ' ' ARG . 12.0 ttm180 -65.6 -48.65 71.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.392 0.515 . . . . 3.52 112.392 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -91.86 2.57 56.44 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.215 0.82 . . . . 1.35 113.215 -171.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.71 56.5 18.74 Favored Glycine 0 C--O 1.25 1.102 0 CA-C-N 116.163 -0.471 . . . . 0.93 112.265 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.451 HG22 ' H ' ' A' ' 59' ' ' SER . 8.7 p -138.68 176.25 6.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 N-CA-C 107.962 -1.125 . . . . 1.72 107.962 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.451 ' H ' HG22 ' A' ' 58' ' ' VAL . 68.8 m -141.17 138.89 33.72 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 109.606 -0.516 . . . . 2.39 109.606 178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.477 HD11 ' HB2' ' A' ' 49' ' ' ALA . 65.6 mt -130.62 120.99 18.96 Favored Pre-proline 0 C--N 1.308 -1.223 0 N-CA-C 108.638 -0.875 . . . . 1.21 108.638 -177.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.402 ' HB2' HG23 ' A' ' 64' ' ' VAL . 38.1 Cg_exo -62.2 124.72 14.88 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.581 2.187 . . . . 1.09 110.175 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -51.66 -31.53 25.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.713 1.205 . . . . 1.83 112.946 -177.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -69.02 -38.41 79.2 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.934 0.397 . . . . 2.34 110.546 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.402 HG23 ' HB2' ' A' ' 61' ' ' PRO . 21.3 t -75.59 -41.8 41.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.0 -1.111 . . . . 1.24 108.0 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -28.16 66.62 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 115.639 -0.71 . . . . 1.13 111.689 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.42 10.77 59.68 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 121.005 -0.617 . . . . 0.61 112.036 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -101.3 -24.39 14.23 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.837 -0.801 . . . . 4.72 108.837 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.533 HG21 HD21 ' A' ' 74' ' ' LEU . 30.3 m -79.14 97.55 2.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-O 122.245 1.022 . . . . 1.15 110.775 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -88.02 -21.01 25.03 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.273 -0.876 . . . . 1.91 111.221 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 p -121.39 142.87 36.31 Favored Pre-proline 0 N--CA 1.413 -2.319 0 CA-C-N 115.998 -0.546 . . . . 1.16 109.572 179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.779 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.7 Cg_exo -53.24 -34.9 71.8 Favored 'Trans proline' 0 CA--C 1.514 -0.478 0 C-N-CA 123.616 2.877 . . . . 0.36 113.34 -178.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -52.79 -44.22 66.43 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 123.475 0.485 . . . . 1.84 110.878 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.404 ' HB3' HG12 ' A' ' 68' ' ' VAL . 60.9 mm-40 -65.46 -47.96 74.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.262 0.625 . . . . 2.13 110.516 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.533 HD21 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -66.99 -42.93 84.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.323 -0.853 . . . . 1.56 110.333 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 51.1 tp -58.33 -50.2 74.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.636 -0.505 . . . . 1.12 109.636 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.42 -41.77 90.3 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.545 0.738 . . . . 0.57 111.094 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.97 -57.18 14.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.029 0.932 . . . . 2.48 108.738 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.3 mt -68.64 -31.85 52.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.51 0 CA-C-N 115.699 -0.682 . . . . 1.19 111.425 -176.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.77 -44.32 93.93 Favored 'General case' 0 N--CA 1.481 1.114 0 O-C-N 122.187 -0.32 . . . . 1.14 110.505 175.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.72 -39.58 90.21 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.378 -0.689 . . . . 0.53 111.378 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.62 -35.33 75.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.64 0.376 . . . . 1.22 111.455 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.6 HD13 ' HG ' ' A' ' 5' ' ' LEU . 55.6 mt -68.67 -31.96 71.46 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 122.927 0.491 . . . . 1.97 111.861 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.572 0 CA-C-O 121.217 0.532 . . . . 1.26 111.294 177.599 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.3 tp . . . . . 0 N--CA 1.405 -2.718 0 CA-C-O 121.272 0.558 . . . . 1.89 109.928 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.468 HD23 ' CE2' ' A' ' 56' ' ' TYR . 87.5 mt -93.97 130.09 40.21 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.225 -0.898 . . . . 1.38 112.076 -174.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.0 p -99.01 -173.83 2.61 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 106.478 -1.675 . . . . 1.29 106.478 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.6 m -56.72 -46.72 81.14 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 118.589 0.631 . . . . 1.31 109.866 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.27 -39.83 93.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.596 0.591 . . . . 1.65 112.596 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.14 -39.97 93.76 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 109.034 -0.728 . . . . 1.41 109.034 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.434 HD11 HD12 ' A' ' 74' ' ' LEU . 19.7 tp -66.17 -51.93 53.03 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 114.927 -1.033 . . . . 1.23 108.294 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.449 ' O ' HG22 ' A' ' 15' ' ' VAL . 37.7 ttm180 -46.98 -47.37 21.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.251 1.42 . . . . 3.04 111.498 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.571 ' HD2' HH22 ' A' ' 55' ' ' ARG . 29.1 ttm180 -56.39 -48.92 75.91 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.857 0.723 . . . . 4.47 110.291 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.21 -37.98 89.4 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.836 -0.62 . . . . 1.19 111.095 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.421 HD11 HG23 ' A' ' 48' ' ' THR . 4.4 mm? -62.93 -45.12 93.97 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.054 -0.351 . . . . 2.05 110.054 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 11' ' ' ARG . 85.5 t -60.0 -52.39 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 109.73 -0.47 . . . . 1.33 109.73 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 42.0 mt-10 -57.55 -41.82 81.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.16 -0.473 . . . . 2.05 111.677 -178.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.531 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.0 m . . . . . 0 C--N 1.315 -0.905 0 N-CA-C 112.038 0.385 . . . . 1.66 112.038 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 t70 . . . . . 0 N--CA 1.439 -0.994 0 N-CA-C 107.547 -1.279 . . . . 2.07 107.547 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 30.9 p90 -135.12 15.55 3.51 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.284 -0.566 . . . . 0.51 111.863 -174.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.569 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 65.0 mt -52.87 -24.86 9.97 Favored 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 116.115 1.895 . . . . 1.12 116.115 -175.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -95.21 -12.25 26.63 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.057 0.39 . . . . 2.04 111.798 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.3 mp -81.17 119.77 24.01 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.421 -0.585 . . . . 2.01 109.421 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 141.55 41.63 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.298 -1.001 . . . . 4.79 108.298 -178.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.455 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.5 m-85 -58.6 -37.95 76.95 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.47 0.481 . . . . 0.43 111.409 -176.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.49 -33.81 64.03 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.37 0.668 . . . . 2.79 111.364 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -82.62 -31.74 28.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.88 110.74 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.408 HG13 ' HD1' ' A' ' 40' ' ' TYR . 24.0 pt -93.16 22.52 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 N-CA-C 112.436 0.532 . . . . 1.25 112.436 -177.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.69 35.4 55.15 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.878 -0.601 . . . . 0.66 113.961 173.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.455 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 14.4 m-85 -108.24 116.9 32.82 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 112.582 0.586 . . . . 1.67 112.582 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -82.68 147.01 28.75 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 106.687 -1.597 . . . . 1.06 106.687 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 p -53.3 -35.93 60.65 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.754 1.02 . . . . 1.52 113.754 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.41 -46.93 71.75 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 109.273 -0.64 . . . . 2.24 109.273 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.435 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -61.45 -33.59 74.0 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.524 0.678 . . . . 1.13 110.33 176.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.412 ' O ' ' HB ' ' A' ' 48' ' ' THR . 51.4 tp -63.75 -51.27 65.65 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.436 -0.802 . . . . 1.15 109.95 175.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.5 mtm -63.79 -30.84 71.89 Favored 'General case' 0 C--O 1.206 -1.224 0 CA-C-N 116.36 -0.382 . . . . 2.13 111.227 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 8.5 tp10 -60.96 -37.89 83.98 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.551 1.14 . . . . 1.88 109.325 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.531 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 71.7 m -67.19 -56.7 8.83 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 113.998 -1.455 . . . . 1.18 107.953 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.518 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.69 -34.99 67.94 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.39 -1.277 . . . . 1.02 110.419 176.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.451 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -59.16 -41.93 89.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.303 0.641 . . . . 1.12 111.549 179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.2 mtt180 -64.86 -42.0 95.23 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.792 -0.64 . . . . 3.59 109.33 176.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 49' ' ' ALA . 91.6 mt -61.71 -41.66 97.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.239 -0.437 . . . . 1.61 110.456 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.518 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.0 mt-10 -57.13 -56.38 22.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.878 -0.601 . . . . 0.48 110.139 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 t -62.77 -50.68 70.07 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.032 -0.986 . . . . 1.75 111.374 -177.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.571 HH22 ' HD2' ' A' ' 12' ' ' ARG . 65.4 ttt180 -63.26 -44.28 95.6 Favored 'General case' 0 C--N 1.313 -0.993 0 C-N-CA 125.05 1.34 . . . . 3.52 113.301 -175.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.468 ' CE2' HD23 ' A' ' 5' ' ' LEU . 92.4 m-85 -97.07 -12.53 23.07 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.612 -0.835 . . . . 1.35 113.178 -176.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 56.65 2.95 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.109 -1.043 . . . . 0.93 110.594 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.46 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 12.6 p -139.51 176.3 6.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.676 -1.231 . . . . 1.72 107.676 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.432 ' H ' HG23 ' A' ' 58' ' ' VAL . 8.1 t -141.96 136.23 30.15 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.973 -1.121 . . . . 2.39 107.973 177.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' A' ' 49' ' ' ALA . 69.2 mt -124.14 126.57 25.55 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.328 -0.249 . . . . 1.21 110.328 -175.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.2 131.45 41.3 Favored 'Trans proline' 0 C--O 1.247 0.96 0 C-N-CA 122.836 2.357 . . . . 1.09 111.573 175.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.26 -40.65 64.78 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.935 1.294 . . . . 1.83 112.496 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.31 -40.89 90.27 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.111 -0.495 . . . . 2.34 111.002 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.2 t -72.63 -40.04 61.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 109.229 -0.656 . . . . 1.24 109.229 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.3 65.82 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.528 -0.76 . . . . 1.13 111.696 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.44 11.47 39.45 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.629 -0.796 . . . . 0.61 112.506 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -97.14 -20.0 18.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.698 0.761 . . . . 4.72 109.841 -177.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.497 HG22 HD21 ' A' ' 74' ' ' LEU . 24.3 m -79.2 117.11 24.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-N 115.093 -0.958 . . . . 1.15 112.229 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -94.4 -39.05 10.66 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 115.506 -0.77 . . . . 1.91 110.677 175.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 47.0 p -104.65 136.91 19.11 Favored Pre-proline 0 N--CA 1.407 -2.589 0 CA-C-N 115.723 -0.671 . . . . 1.16 111.112 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.569 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.8 Cg_exo -52.17 -35.69 63.86 Favored 'Trans proline' 0 CA--C 1.516 -0.411 0 C-N-CA 124.079 3.186 . . . . 0.36 113.787 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -53.42 -42.66 67.26 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.851 0.315 . . . . 1.84 111.851 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -65.14 -46.01 82.68 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.184 0.594 . . . . 2.13 110.55 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.497 HD21 HG22 ' A' ' 68' ' ' VAL . 3.4 tm? -65.84 -48.74 70.6 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.11 -0.95 . . . . 1.56 109.411 -178.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.01 -54.59 45.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 1.12 110.922 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.12 -40.61 98.11 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 112.626 0.602 . . . . 0.57 112.626 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.23 -48.65 80.5 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 108.86 -0.793 . . . . 2.48 108.86 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 65.9 mt -67.16 -35.16 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 116.074 -0.512 . . . . 1.19 110.702 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -57.41 -43.45 83.77 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 110.124 -0.324 . . . . 1.14 110.124 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.48 -40.22 97.52 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.825 -0.625 . . . . 0.53 111.919 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.5 -41.99 71.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.104 0.478 . . . . 1.22 111.032 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.32 -31.43 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 1.97 111.855 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.494 0 CA-C-O 120.966 0.412 . . . . 1.26 111.688 -179.313 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.7 mp . . . . . 0 CA--C 1.487 -1.472 0 CA-C-O 121.266 0.555 . . . . 1.89 109.813 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.481 ' O ' HD13 ' A' ' 75' ' ' LEU . 1.4 mm? -71.62 139.41 49.3 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.763 -1.108 . . . . 1.38 109.732 -176.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.7 p -97.64 -170.69 2.04 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 105.181 -2.155 . . . . 1.29 105.181 167.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.762 HG23 ' HA ' ' A' ' 29' ' ' ASP . 41.8 m -56.92 -47.54 80.37 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 119.244 0.929 . . . . 1.31 110.123 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.8 -48.36 79.94 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.977 -0.556 . . . . 1.65 112.387 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.412 ' HB3' HD12 ' A' ' 5' ' ' LEU . 16.2 m-20 -66.15 -38.6 88.5 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.134 -0.484 . . . . 1.41 110.484 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.401 HD11 ' CD1' ' A' ' 74' ' ' LEU . 16.5 tp -66.95 -46.8 73.58 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 108.4 -0.963 . . . . 1.23 108.4 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.4 ' O ' HG23 ' A' ' 15' ' ' VAL . 41.1 ttp180 -53.54 -46.48 70.2 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 123.792 0.837 . . . . 3.04 110.858 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.5 ttt180 -54.33 -50.55 67.13 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.391 0.432 . . . . 4.47 110.251 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.42 -40.65 95.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.752 -0.658 . . . . 1.19 111.351 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.409 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 10.2 mp -64.21 -44.03 93.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.875 -0.33 . . . . 2.05 111.786 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 11' ' ' ARG . 96.9 t -60.93 -45.42 98.38 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 N-CA-C 109.928 -0.397 . . . . 1.33 109.928 178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 42.3 mt-10 -60.58 -47.52 85.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 2.05 110.955 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.527 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 38.9 m . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.642 -0.708 . . . . 1.66 112.484 -177.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.762 ' HA ' HG23 ' A' ' 7' ' ' THR . 11.5 t70 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 106.101 -1.815 . . . . 2.07 106.101 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -110.46 25.57 11.64 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.706 -0.679 . . . . 0.51 112.35 -169.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.762 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 50.6 mt -50.36 -27.75 6.84 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.061 1.874 . . . . 1.12 116.061 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -97.58 -5.19 36.18 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 118.43 0.559 . . . . 2.04 112.061 -177.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.416 HD23 HG21 ' A' ' 38' ' ' ILE . 9.4 mp -77.18 125.14 28.84 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.525 -0.734 . . . . 2.01 111.115 -177.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 69' ' ' ASP . 10.4 mpt_? -73.74 129.62 38.29 Favored 'General case' 0 C--O 1.247 0.951 0 N-CA-C 108.438 -0.949 . . . . 4.79 108.438 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 80.6 m-85 -55.05 -50.37 69.27 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.296 0.997 . . . . 0.43 113.399 -173.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -53.51 -27.04 23.43 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 113.179 0.807 . . . . 2.79 113.179 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.78 -33.05 27.44 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.371 0.605 . . . . 0.88 110.187 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.416 HG21 HD23 ' A' ' 33' ' ' LEU . 12.6 pt -96.75 22.81 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 112.958 0.725 . . . . 1.25 112.958 -175.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.17 21.77 54.02 Favored Glycine 0 CA--C 1.506 -0.483 0 CA-C-N 115.799 -0.637 . . . . 0.66 113.997 174.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 26.6 m-85 -123.06 102.6 8.08 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 112.023 0.379 . . . . 1.67 112.023 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -82.34 147.22 28.96 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 106.914 -1.513 . . . . 1.06 106.914 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.575 ' O ' ' HG3' ' A' ' 46' ' ' MET . 23.8 m -50.01 -22.44 1.59 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.839 1.051 . . . . 1.52 113.839 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.57 -58.76 5.46 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.764 -0.585 . . . . 2.24 110.006 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.489 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -62.68 -26.83 68.86 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.645 0.736 . . . . 1.13 109.86 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.564 HD23 HG23 ' A' ' 68' ' ' VAL . 28.8 tp -64.28 -47.23 80.32 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 115.393 -0.821 . . . . 1.15 110.251 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 42' ' ' SER . 56.0 mtm -63.58 -33.12 74.89 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 110.051 -0.352 . . . . 2.13 110.051 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 10.9 tp10 -60.55 -37.82 82.48 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 121.957 0.884 . . . . 1.88 109.349 176.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.446 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 79.4 m -70.14 -55.98 8.03 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.319 -1.309 . . . . 1.18 107.866 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.629 ' HA ' HD11 ' A' ' 52' ' ' LEU . . . -54.9 -36.03 64.76 Favored 'General case' 0 C--O 1.203 -1.356 0 CA-C-N 114.0 -1.455 . . . . 1.02 110.809 178.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.52 83.62 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-O 121.538 0.685 . . . . 1.12 112.015 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.527 ' CZ ' ' HA ' ' A' ' 17' ' ' SER . 77.6 mtt180 -68.9 -37.83 79.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.279 -0.873 . . . . 3.59 109.599 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 49' ' ' ALA . 56.8 mt -62.75 -46.32 88.6 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.903 -1.044 . . . . 1.61 109.557 176.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -55.98 -58.06 9.49 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.606 -0.725 . . . . 0.48 111.218 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.0 t -63.13 -56.37 17.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.38 -0.827 . . . . 1.75 112.284 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.533 ' HD2' ' CZ ' ' A' ' 56' ' ' TYR . 35.5 ttm180 -65.02 -43.82 91.18 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.769 0.655 . . . . 3.52 112.769 -173.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.533 ' CZ ' ' HD2' ' A' ' 55' ' ' ARG . 61.7 m-85 -98.04 -3.26 38.45 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.175 -0.61 . . . . 1.35 112.514 -173.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.62 43.42 43.87 Favored Glycine 0 C--N 1.318 -0.425 0 C-N-CA 120.645 -0.788 . . . . 0.93 112.822 176.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.4 p -114.91 143.15 25.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 N-CA-C 109.421 -0.585 . . . . 1.72 109.421 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 m -99.74 120.35 39.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 109.126 -0.694 . . . . 2.39 109.126 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.1 mt -126.56 107.39 23.4 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 109.434 -0.58 . . . . 1.21 109.434 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.68 141.75 97.92 Favored 'Trans proline' 0 C--O 1.242 0.691 0 C-N-CA 122.324 2.016 . . . . 1.09 110.97 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -52.2 -39.84 60.72 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.432 1.093 . . . . 1.83 112.465 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.676 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 32.8 t70 -69.01 -38.81 79.45 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.58 -0.282 . . . . 2.34 110.88 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.6 t -69.97 -38.29 74.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.897 -0.779 . . . . 1.24 108.897 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -21.42 59.03 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.58 -0.736 . . . . 1.13 111.819 176.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.3 7.74 28.69 Favored Glycine 0 N--CA 1.442 -0.941 0 C-N-CA 121.162 -0.542 . . . . 0.61 112.219 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 24.3 mmm180 -101.31 -15.55 17.22 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.541 0.686 . . . . 4.72 109.958 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.564 HG23 HD23 ' A' ' 45' ' ' LEU . 30.9 m -78.07 101.39 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-O 122.456 1.122 . . . . 1.15 109.42 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.45 ' OD2' HG22 ' A' ' 70' ' ' THR . 8.5 t70 -88.2 -25.76 22.74 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.041 -1.436 . . . . 1.91 111.262 -177.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.45 HG22 ' OD2' ' A' ' 69' ' ' ASP . 30.1 p -133.62 147.39 64.39 Favored Pre-proline 0 N--CA 1.422 -1.838 0 CA-C-N 115.432 -0.804 . . . . 1.16 108.944 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.762 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 57.1 Cg_exo -55.7 -35.77 93.8 Favored 'Trans proline' 0 C--O 1.208 -0.98 0 C-N-CA 123.302 2.668 . . . . 0.36 112.037 177.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.572 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 9.8 ptm180 -54.33 -39.8 67.4 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 123.209 0.318 . . . . 1.84 111.615 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -67.33 -48.78 66.52 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 121.544 0.688 . . . . 2.13 110.693 174.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.513 HD23 HG22 ' A' ' 68' ' ' VAL . 3.2 tm? -66.35 -48.19 71.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.636 -1.165 . . . . 1.56 111.682 -174.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 5' ' ' LEU . 31.3 tp -57.02 -47.53 80.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 123.027 0.531 . . . . 1.12 109.709 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.21 -43.18 96.17 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.055 -0.975 . . . . 0.57 111.303 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.42 -48.82 79.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.793 -0.639 . . . . 2.48 109.536 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.408 ' CD1' HD13 ' A' ' 52' ' ' LEU . 49.1 mt -65.76 -43.08 93.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 N-CA-C 110.359 -0.237 . . . . 1.19 110.359 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.06 -43.01 91.67 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 120.785 -0.366 . . . . 1.14 110.445 177.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.7 -40.05 93.83 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 116.056 -0.52 . . . . 0.53 112.301 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.18 71.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.076 0.465 . . . . 1.22 110.518 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.9 mt -70.3 -16.53 63.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.083 -0.508 . . . . 1.97 112.001 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 120.865 0.364 . . . . 1.26 110.688 175.106 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.8 tp . . . . . 0 N--CA 1.389 -3.491 0 N-CA-C 109.393 -0.595 . . . . 1.89 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.439 ' O ' HD11 ' A' ' 75' ' ' LEU . 84.8 mt -106.74 126.36 52.2 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 108.901 -0.777 . . . . 1.38 108.901 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -93.42 -173.35 3.19 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.074 -1.454 . . . . 1.29 107.074 171.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.895 HG22 ' HA ' ' A' ' 29' ' ' ASP . 11.0 m -56.96 -47.14 81.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.087 -0.709 . . . . 1.31 109.087 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -58.74 -47.34 84.94 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.226 -0.897 . . . . 1.65 112.055 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -66.29 -32.29 73.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 120.652 -0.419 . . . . 1.41 110.489 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.405 HD13 ' CD1' ' A' ' 74' ' ' LEU . 17.8 tp -68.09 -46.73 70.18 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.807 -0.812 . . . . 1.23 108.807 178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.567 ' O ' HG23 ' A' ' 15' ' ' VAL . 47.3 ttp180 -51.57 -48.39 63.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.791 -0.64 . . . . 3.04 110.574 176.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.477 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.7 ttm105 -53.39 -43.4 67.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 115.479 -0.782 . . . . 4.47 111.54 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.76 98.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.032 0.444 . . . . 1.19 110.614 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.465 HD12 HG23 ' A' ' 48' ' ' THR . 10.2 mp -65.95 -37.43 86.01 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.939 -0.573 . . . . 2.05 110.893 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 11' ' ' ARG . 16.5 t -71.47 -36.6 61.24 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 121.462 0.648 . . . . 1.33 109.398 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 60.3 mm-40 -64.04 -34.17 77.4 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.65 -0.657 . . . . 2.05 111.065 176.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 CA--C 1.559 1.312 0 CA-C-N 116.309 -0.405 . . . . 1.66 111.498 -177.895 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.895 ' HA ' HG22 ' A' ' 7' ' ' THR . 17.4 m-20 . . . . . 0 CA--C 1.487 -1.452 0 N-CA-C 109.821 -0.437 . . . . 2.07 109.821 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -112.88 9.91 18.96 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.547 -0.751 . . . . 0.51 109.98 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.828 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 59.0 mt -52.93 -24.85 10.15 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.86 1.43 . . . . 1.12 114.86 -177.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -93.25 -19.94 20.91 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 120.819 0.342 . . . . 2.04 110.547 -176.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 mp -77.89 125.0 28.69 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 109.347 -0.612 . . . . 2.01 109.347 -176.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -74.85 135.61 41.58 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.743 -0.836 . . . . 4.79 108.743 -177.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -56.85 -46.65 81.6 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.354 0.409 . . . . 0.43 109.914 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -55.08 -28.54 53.18 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.156 0.982 . . . . 2.79 111.247 178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -85.59 -32.83 21.88 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.812 -0.631 . . . . 0.88 111.873 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -96.26 30.4 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 113.836 1.051 . . . . 1.25 113.836 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.96 -16.78 60.6 Favored Glycine 0 C--N 1.316 -0.531 0 C-N-CA 120.587 -0.816 . . . . 0.66 113.521 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.431 ' CZ ' HD23 ' A' ' 14' ' ' LEU . 35.5 m-85 -81.61 163.93 22.22 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.718 0.771 . . . . 1.67 111.578 -177.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -135.46 140.84 45.17 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.088 -1.819 . . . . 1.06 106.088 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 46' ' ' MET . 57.6 p -48.45 -32.57 7.96 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 124.562 1.145 . . . . 1.52 113.641 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.814 ' HA ' ' HE2' ' A' ' 46' ' ' MET . 6.1 tt -64.98 -50.63 65.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.482 -0.562 . . . . 2.24 109.482 177.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 -36.15 81.61 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.41 0.624 . . . . 1.13 110.293 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.532 HD21 HG21 ' A' ' 68' ' ' VAL . 61.0 tp -61.25 -37.15 82.05 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.83 -1.077 . . . . 1.15 110.54 179.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.814 ' HE2' ' HA ' ' A' ' 43' ' ' LEU . 70.0 mtm -63.1 -33.1 74.72 Favored 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 111.884 0.327 . . . . 2.13 111.884 178.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.66 -37.42 87.52 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.09 0.948 . . . . 1.88 109.468 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.465 HG23 HD12 ' A' ' 14' ' ' LEU . 31.2 m -66.94 -54.6 20.41 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.295 -1.321 . . . . 1.18 108.073 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.484 ' HB1' HD13 ' A' ' 60' ' ' ILE . . . -57.63 -34.81 69.71 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 114.916 -1.038 . . . . 1.02 110.044 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.94 -41.9 88.48 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 123.237 0.615 . . . . 1.12 111.322 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 mtp180 -64.93 -40.71 95.46 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 115.34 -0.845 . . . . 3.59 110.024 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.96 -41.14 97.65 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.974 -0.557 . . . . 1.61 110.922 178.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.5 mt-10 -56.58 -55.0 39.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 123.686 0.616 . . . . 0.48 109.58 174.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -63.87 -42.44 97.51 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.097 -0.956 . . . . 1.75 111.757 -177.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -65.15 -51.91 58.35 Favored 'General case' 0 C--O 1.215 -0.725 0 C-N-CA 123.034 0.534 . . . . 3.52 111.636 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -93.68 -7.74 42.9 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 113.52 0.933 . . . . 1.35 113.52 -171.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.92 53.95 4.71 Favored Glycine 0 C--N 1.312 -0.793 0 C-N-CA 120.458 -0.877 . . . . 0.93 111.357 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.438 HG23 ' H ' ' A' ' 59' ' ' SER . 9.9 p -139.5 176.33 6.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.001 -1.111 . . . . 1.72 108.001 -177.349 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.438 ' H ' HG23 ' A' ' 58' ' ' VAL . 12.1 p -141.81 140.92 33.11 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 118.624 0.647 . . . . 2.39 110.422 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.484 HD13 ' HB1' ' A' ' 49' ' ' ALA . 61.2 mt -126.25 123.32 24.25 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.096 -1.076 . . . . 1.21 108.096 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.57 128.07 25.87 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.361 2.041 . . . . 1.09 110.1 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.66 -27.86 29.9 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.962 0.905 . . . . 1.83 113.355 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -67.2 -44.71 78.94 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.495 -0.557 . . . . 2.34 109.495 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.89 -41.94 60.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.852 -0.796 . . . . 1.24 108.852 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.98 -27.82 63.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.68 -0.691 . . . . 1.13 111.854 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.35 -1.51 47.49 Favored Glycine 0 N--CA 1.44 -1.087 0 C-N-CA 120.437 -0.887 . . . . 0.61 112.052 177.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -99.57 -10.55 21.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.295 0.569 . . . . 4.72 110.549 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.532 HG21 HD21 ' A' ' 45' ' ' LEU . 13.2 m -79.32 103.82 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.805 0 CA-C-O 121.582 0.706 . . . . 1.15 110.041 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.93 -40.36 14.88 Favored 'General case' 0 CA--C 1.482 -1.67 0 CA-C-N 115.523 -0.762 . . . . 1.91 110.862 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.1 p -107.86 133.03 20.62 Favored Pre-proline 0 N--CA 1.402 -2.865 0 CA-C-N 115.261 -0.881 . . . . 1.16 110.153 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.828 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.7 Cg_exo -50.71 -31.75 33.71 Favored 'Trans proline' 0 C--O 1.213 -0.755 0 C-N-CA 123.867 3.045 . . . . 0.36 113.285 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.409 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 11.5 ptp85 -52.94 -48.1 67.57 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 120.923 0.392 . . . . 1.84 110.781 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 10.5 mm-40 -66.15 -41.45 90.38 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 123.88 0.872 . . . . 2.13 110.651 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.51 HD21 HG23 ' A' ' 68' ' ' VAL . 3.0 tm? -68.26 -45.55 72.85 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.092 -0.958 . . . . 1.56 109.454 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.439 HD11 ' O ' ' A' ' 5' ' ' LEU . 32.3 tp -57.16 -51.9 67.45 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.724 -0.671 . . . . 1.12 109.392 178.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -56.65 -45.0 81.86 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.044 0.938 . . . . 0.57 112.1 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.39 -49.33 77.32 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.296 -0.631 . . . . 2.48 109.296 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 61.6 mt -66.88 -45.21 88.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 116.168 -0.469 . . . . 1.19 110.396 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -45.95 71.77 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.563 0.345 . . . . 1.14 110.671 177.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.6 -42.56 97.31 Favored Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.887 -0.597 . . . . 0.53 112.377 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.62 -38.28 80.42 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.323 0.249 . . . . 1.22 110.818 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 80.3 mt -60.79 -46.18 91.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.385 0.612 . . . . 1.97 110.28 177.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 115.672 -0.695 . . . . 1.26 111.548 177.733 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 tp . . . . . 0 N--CA 1.421 -1.885 0 CA-C-O 121.64 0.734 . . . . 1.89 112.075 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.08 127.07 35.99 Favored 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 114.865 -1.061 . . . . 1.38 109.827 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -101.2 179.82 4.26 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 107.07 -1.455 . . . . 1.29 107.07 170.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.847 HG22 ' HA ' ' A' ' 29' ' ' ASP . 19.4 m -58.29 -40.88 83.14 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.413 0.625 . . . . 1.31 109.594 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.39 -53.7 55.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 114.747 -1.115 . . . . 1.65 111.237 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 12' ' ' ARG . 8.5 t70 -69.6 -33.23 72.39 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 121.293 0.568 . . . . 1.41 110.395 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.483 HD11 HD12 ' A' ' 74' ' ' LEU . 17.8 tp -65.32 -45.89 82.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.158 -0.682 . . . . 1.23 109.158 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 15' ' ' VAL . 45.4 ttp180 -54.25 -43.91 71.34 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 123.937 0.895 . . . . 3.04 109.978 176.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 53.6 ttt180 -54.84 -45.82 74.54 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 115.163 -0.926 . . . . 4.47 110.726 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.438 ' HB2' HD23 ' A' ' 52' ' ' LEU . . . -61.05 -40.65 94.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.094 -0.503 . . . . 1.19 111.148 -178.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -64.78 -44.2 90.74 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 121.105 -0.238 . . . . 2.05 111.201 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 11' ' ' ARG . 60.6 t -63.19 -47.95 89.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.284 -0.416 . . . . 1.33 110.019 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.04 -32.17 73.47 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.832 0.308 . . . . 2.05 111.832 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.492 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 35.7 t . . . . . 0 C--N 1.313 -0.989 0 CA-C-O 120.773 0.321 . . . . 1.66 111.395 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.847 ' HA ' HG22 ' A' ' 7' ' ' THR . 4.2 m-20 . . . . . 0 CA--C 1.49 -1.359 0 CA-C-O 121.319 0.581 . . . . 2.07 110.638 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.419 ' HA ' HD21 ' A' ' 33' ' ' LEU . 21.7 p90 -95.35 13.26 26.31 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.391 -0.822 . . . . 0.51 110.144 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.707 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 58.6 mt -50.82 -23.95 3.14 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.82 1.785 . . . . 1.12 115.82 -175.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.98 -8.93 32.39 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.39 0.614 . . . . 2.04 111.414 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.419 HD21 ' HA ' ' A' ' 30' ' ' PHE . 3.9 mm? -79.12 123.72 27.63 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.612 -0.514 . . . . 2.01 109.612 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -75.48 141.52 43.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.175 -1.046 . . . . 4.79 108.175 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.403 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.6 m-85 -59.99 -41.38 91.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 110.278 -0.268 . . . . 0.43 110.278 -178.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -57.76 -27.37 62.99 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.355 0.597 . . . . 2.79 111.344 176.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -84.79 -33.96 22.88 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.094 0.473 . . . . 0.88 110.895 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.2 pt -93.15 16.91 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.634 0.605 . . . . 1.25 112.634 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.79 43.18 18.84 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 116.059 -0.519 . . . . 0.66 113.411 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.403 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 15.2 m-85 -126.93 117.09 21.84 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 122.684 -0.304 . . . . 1.67 111.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.43 151.85 24.39 Favored 'General case' 0 CA--C 1.474 -1.956 0 N-CA-C 108.269 -1.011 . . . . 1.06 108.269 171.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.414 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 15.7 p -53.45 -30.35 40.15 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.616 0.969 . . . . 1.52 113.616 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.76 -54.59 36.84 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.625 -0.88 . . . . 2.24 108.625 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.06 80.16 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.053 0.541 . . . . 1.13 111.064 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.529 ' O ' ' HB ' ' A' ' 48' ' ' THR . 65.0 tp -64.3 -41.07 97.04 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.907 -0.588 . . . . 1.15 110.912 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 71.4 mtm -64.28 -31.73 73.05 Favored 'General case' 0 C--O 1.196 -1.723 0 O-C-N 122.026 -0.422 . . . . 2.13 111.541 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.563 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 9.3 tp10 -63.58 -33.03 74.7 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.731 0.777 . . . . 1.88 109.237 174.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.529 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 39.7 m -66.4 -55.32 16.36 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.398 -1.334 . . . . 1.18 107.398 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.426 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.06 -39.69 75.41 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-N 114.345 -1.298 . . . . 1.02 109.888 175.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.25 -45.98 86.79 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 123.775 0.83 . . . . 1.12 111.95 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 56.4 mtt180 -65.03 -37.15 86.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.707 -0.679 . . . . 3.59 109.908 178.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' A' ' 13' ' ' ALA . 81.3 mt -65.59 -38.94 90.93 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 116.049 -0.523 . . . . 1.61 111.039 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.6 mt-10 -56.6 -55.08 38.5 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.626 0.579 . . . . 0.48 109.482 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 m -62.07 -40.61 96.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.518 -0.764 . . . . 1.75 112.136 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -66.09 -49.46 67.52 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.124 -0.489 . . . . 3.52 112.14 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -98.51 -11.16 22.54 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.947 1.462 . . . . 1.35 114.947 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.74 53.08 6.66 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.415 -0.898 . . . . 0.93 111.188 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.6 p -135.24 137.49 50.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 0 N-CA-C 108.448 -0.945 . . . . 1.72 108.448 -177.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.4 m -96.57 114.54 26.21 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 120.722 0.296 . . . . 2.39 110.7 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.2 mt -104.62 122.24 44.28 Favored Pre-proline 0 C--N 1.32 -0.695 0 C-N-CA 122.931 0.492 . . . . 1.21 109.969 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -67.78 131.73 24.95 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.956 2.437 . . . . 1.09 112.07 178.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -52.06 -40.51 61.26 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.848 1.259 . . . . 1.83 113.742 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.44 -37.85 83.63 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.901 -0.32 . . . . 2.34 110.533 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 34.0 t -75.23 -42.01 44.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.891 -0.781 . . . . 1.24 108.891 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.88 -32.05 69.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.603 -0.726 . . . . 1.13 111.386 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.87 9.68 63.97 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.73 -0.748 . . . . 0.61 112.273 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -100.41 -24.13 14.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.952 0.406 . . . . 4.72 110.292 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.503 HG22 HD22 ' A' ' 74' ' ' LEU . 20.8 m -75.68 103.88 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 CA-C-O 122.029 0.918 . . . . 1.15 111.032 -177.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.74 -30.32 20.4 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-N 115.132 -0.94 . . . . 1.91 111.488 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 38.4 p -122.51 145.53 45.04 Favored Pre-proline 0 N--CA 1.419 -1.981 0 CA-C-N 115.946 -0.57 . . . . 1.16 109.836 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.707 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.4 Cg_exo -53.07 -40.73 75.77 Favored 'Trans proline' 0 CA--C 1.509 -0.773 0 C-N-CA 124.023 3.148 . . . . 0.36 114.024 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.9 ptp85 -52.36 -39.78 61.17 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 123.495 0.497 . . . . 1.84 111.663 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.22 -51.55 63.15 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.933 -0.576 . . . . 2.13 109.837 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.503 HD22 HG22 ' A' ' 68' ' ' VAL . 3.4 tm? -67.34 -39.76 85.83 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.619 -1.173 . . . . 1.56 110.213 -176.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.0 tp -56.91 -57.67 11.5 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 109.219 -0.659 . . . . 1.12 109.219 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.87 -37.86 74.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 123.766 0.666 . . . . 0.57 111.438 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -59.57 -53.08 62.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.682 -0.69 . . . . 2.48 110.439 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.487 HG23 HD13 ' A' ' 82' ' ' LEU . 44.9 mt -76.08 -21.92 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 C-N-CA 120.364 -0.534 . . . . 1.19 110.53 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -64.83 -50.29 67.28 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.853 -0.795 . . . . 1.14 108.853 173.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.66 -38.24 95.41 Favored Glycine 0 N--CA 1.439 -1.125 0 CA-C-N 115.249 -0.887 . . . . 0.53 111.668 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.75 -39.11 84.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.433 0.159 . . . . 1.22 110.845 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.487 HD13 HG23 ' A' ' 78' ' ' ILE . 5.3 mp -70.86 -39.01 73.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 122.357 0.263 . . . . 1.97 111.4 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.479 0 CA-C-O 121.567 0.698 . . . . 1.26 110.019 175.582 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.508 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 22.6 tp . . . . . 0 N--CA 1.418 -2.034 0 N-CA-C 103.616 -2.735 . . . . 1.89 103.616 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.508 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 94.9 mt -117.35 124.22 48.39 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 108.157 -1.053 . . . . 1.38 108.157 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.9 p -97.6 -171.38 2.17 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 107.836 -1.172 . . . . 1.29 107.836 170.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.1 m -52.25 -54.98 24.33 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 123.891 0.876 . . . . 1.31 111.436 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.42 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . 32.1 t70 -72.07 -28.13 63.13 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 112.713 0.634 . . . . 1.65 112.713 -178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.47 -44.98 85.45 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.573 -0.899 . . . . 1.41 108.573 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.68 -47.39 75.63 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.626 -1.17 . . . . 1.23 108.881 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.42 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 36.7 ttt-85 -49.54 -51.51 36.13 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.343 1.057 . . . . 3.04 110.963 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 65.6 ttt180 -59.08 -50.58 73.54 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.435 -0.348 . . . . 4.47 111.581 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.26 -36.22 77.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.13 -0.486 . . . . 1.19 111.323 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.59 HD21 HG22 ' A' ' 48' ' ' THR . 99.1 mt -63.34 -53.52 51.37 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.523 0.514 . . . . 2.05 110.169 177.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 94.6 t -57.97 -45.92 87.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.949 -0.569 . . . . 1.33 111.355 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.602 ' HB2' HH12 ' A' ' 51' ' ' ARG . 55.6 mt-10 -60.87 -30.46 70.15 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.503 -0.317 . . . . 2.05 111.723 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 C--N 1.319 -0.724 0 C-N-CA 121.128 -0.229 . . . . 1.66 111.428 -176.435 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 CA--C 1.502 -0.895 0 N-CA-C 109.264 -0.643 . . . . 2.07 109.264 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -100.36 3.66 43.43 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.921 -0.77 . . . . 0.51 108.921 176.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.634 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 41.4 mt -54.2 -26.68 29.59 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.541 1.136 . . . . 1.12 113.99 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -90.32 -19.31 24.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.733 0.778 . . . . 2.04 110.445 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -81.96 123.71 29.12 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.317 -0.994 . . . . 2.01 108.317 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.63 146.0 42.79 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 116.278 -0.419 . . . . 4.79 110.292 -176.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 70.2 m-85 -61.94 -32.91 73.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.342 0.591 . . . . 0.43 109.543 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -54.72 -40.68 69.48 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.739 -1.119 . . . . 2.79 110.182 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -81.1 -33.34 33.39 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.941 -1.027 . . . . 0.88 111.06 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.521 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.5 pt -92.14 19.55 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 112.26 0.467 . . . . 1.25 112.26 -177.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 69.34 46.33 57.15 Favored Glycine 0 CA--C 1.511 -0.177 0 CA-C-N 116.122 -0.49 . . . . 0.66 113.626 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.528 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 7.7 m-85 -118.86 124.89 48.25 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 120.724 0.297 . . . . 1.67 111.502 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -84.7 134.1 34.36 Favored 'General case' 0 CA--C 1.484 -1.572 0 N-CA-C 107.709 -1.219 . . . . 1.06 107.709 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.498 ' O ' ' HB3' ' A' ' 45' ' ' LEU . 15.9 m -53.63 -26.12 20.72 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 123.607 0.567 . . . . 1.52 111.418 174.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.7 tp -64.7 -49.89 69.13 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.78 -0.575 . . . . 2.24 110.099 174.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.86 73.28 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 122.128 0.966 . . . . 1.13 109.702 177.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.587 HD21 HG22 ' A' ' 68' ' ' VAL . 33.8 tp -62.77 -50.64 70.23 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.49 -1.232 . . . . 1.15 108.957 176.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.9 mtp -62.56 -33.29 74.66 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.264 -0.425 . . . . 2.13 110.823 176.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.71 -36.59 81.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 122.159 0.981 . . . . 1.88 108.757 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.59 HG22 HD21 ' A' ' 14' ' ' LEU . 89.3 m -68.57 -57.65 5.44 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.245 -1.391 . . . . 1.18 107.245 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.606 ' HA ' HD11 ' A' ' 52' ' ' LEU . . . -54.82 -33.02 61.08 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.908 -1.496 . . . . 1.02 111.07 178.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.65 -46.92 83.57 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.154 0.502 . . . . 1.12 111.567 178.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.602 HH12 ' HB2' ' A' ' 16' ' ' GLU . 66.7 mtp180 -64.07 -37.79 88.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.307 -0.861 . . . . 3.59 109.634 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.606 HD11 ' HA ' ' A' ' 49' ' ' ALA . 65.1 mt -66.14 -47.97 72.31 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 1.61 110.295 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.9 mt-10 -58.43 -40.58 82.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.903 0.383 . . . . 0.48 110.246 175.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.8 t -61.26 -64.39 0.97 Allowed 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.203 -0.908 . . . . 1.75 111.005 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -63.86 -41.67 97.72 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.354 0.872 . . . . 3.52 113.354 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -93.2 -4.5 51.9 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 112.999 0.741 . . . . 1.35 112.999 -171.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.86 26.06 72.07 Favored Glycine 0 C--O 1.239 0.456 0 C-N-CA 120.981 -0.628 . . . . 0.93 112.562 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.755 HG13 HD21 ' A' ' 82' ' ' LEU . 28.9 m -99.15 173.96 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.937 -0.132 . . . . 1.72 110.749 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.2 p -141.9 113.68 7.91 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-O 121.421 0.629 . . . . 2.39 112.05 -176.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.473 HD12 ' HB2' ' A' ' 49' ' ' ALA . 63.4 mt -103.92 127.29 29.65 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 108.509 -0.923 . . . . 1.21 108.509 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.72 136.66 68.04 Favored 'Trans proline' 0 C--O 1.242 0.681 0 C-N-CA 122.37 2.047 . . . . 1.09 110.645 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -52.72 -41.87 64.35 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.902 0.704 . . . . 1.83 112.902 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.28 -32.51 72.72 Favored 'General case' 0 C--O 1.183 -2.429 0 CA-C-N 116.481 -0.327 . . . . 2.34 110.447 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.6 -44.74 46.6 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 N-CA-C 109.093 -0.706 . . . . 1.24 109.093 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.04 -35.37 66.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.531 0.732 . . . . 1.13 112.516 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.54 23.08 27.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.538 -0.839 . . . . 0.61 112.967 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -134.87 -0.28 2.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.8 0.81 . . . . 4.72 110.451 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.587 HG22 HD21 ' A' ' 45' ' ' LEU . 6.3 m -78.5 101.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.268 -1.012 . . . . 1.15 108.268 173.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -89.96 -30.52 17.75 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 114.49 -1.232 . . . . 1.91 110.295 -173.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.425 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.4 p -114.85 130.61 24.01 Favored Pre-proline 0 N--CA 1.403 -2.788 0 CA-C-N 115.085 -0.962 . . . . 1.16 109.914 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.634 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 86.4 Cg_exo -47.91 -46.74 20.85 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.095 3.197 . . . . 0.36 113.738 -175.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.612 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 18.2 ptt180 -54.33 -37.28 64.69 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 114.155 1.169 . . . . 1.84 114.155 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -66.54 -43.56 84.8 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.159 0.504 . . . . 2.13 110.976 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.483 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 3.2 tm? -69.22 -45.07 70.73 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.203 -0.908 . . . . 1.56 109.398 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.6 tp -56.31 -49.79 73.3 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 123.454 0.702 . . . . 1.12 109.411 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -57.23 -46.11 83.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.166 -0.925 . . . . 0.57 111.503 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -61.05 -47.12 87.83 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.241 -0.651 . . . . 2.48 109.241 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 58.3 mt -70.3 -27.98 33.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.795 0.331 . . . . 1.19 111.563 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -39.23 83.91 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 121.922 -0.486 . . . . 1.14 110.032 174.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.51 -39.58 91.09 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.772 -0.931 . . . . 0.53 110.772 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.28 87.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.677 0.275 . . . . 1.22 110.503 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.755 HD21 HG13 ' A' ' 58' ' ' VAL . 4.0 mm? -69.74 -27.57 65.06 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 111.878 0.325 . . . . 1.97 111.878 176.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.748 0 CA-C-O 121.471 0.653 . . . . 1.26 109.483 174.814 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.434 ' HB3' ' OD1' ' A' ' 79' ' ' ASN . 9.1 mp . . . . . 0 N--CA 1.44 -0.945 0 CA-C-O 121.819 0.819 . . . . 1.89 112.218 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.447 HD13 ' CD1' ' A' ' 52' ' ' LEU . 38.6 mt -96.05 142.69 27.95 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.16 -0.927 . . . . 1.38 112.329 -167.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.8 p -101.99 -178.15 3.62 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.451 -1.685 . . . . 1.29 106.451 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.849 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.4 m -59.88 -32.92 71.17 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.315 0.578 . . . . 1.31 110.081 175.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.58 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 15.7 t70 -67.82 -42.76 81.0 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.627 -0.715 . . . . 1.65 110.043 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -63.92 -38.29 90.53 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.55 -0.75 . . . . 1.41 109.476 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.4 tp -66.32 -45.68 79.46 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.182 -0.917 . . . . 1.23 109.844 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttp180 -52.41 -46.27 66.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.762 0.425 . . . . 3.04 111.024 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 94.4 mtt180 -54.66 -50.1 69.0 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.531 -0.759 . . . . 4.47 110.187 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.15 87.32 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.402 -0.817 . . . . 1.19 111.841 -175.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.02 -45.74 80.41 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.159 -0.216 . . . . 2.05 110.667 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.3 t -57.09 -40.33 72.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.151 0.5 . . . . 1.33 110.052 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 70.1 mm-40 -60.53 -40.08 90.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.741 -0.663 . . . . 2.05 111.408 177.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.31 -1.145 0 CA-C-N 115.492 -0.776 . . . . 1.66 112.162 -174.195 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.849 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.4 t70 . . . . . 0 N--CA 1.43 -1.44 0 N-CA-C 109.104 -0.702 . . . . 2.07 109.104 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.421 ' HA ' HD21 ' A' ' 33' ' ' LEU . 28.2 p90 -105.4 19.4 20.64 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 116.049 -0.523 . . . . 0.51 111.161 -177.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.838 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 57.9 mt -52.19 -22.9 4.75 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.95 1.463 . . . . 1.12 114.95 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.97 -20.42 19.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.654 0.264 . . . . 2.04 111.513 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' A' ' 30' ' ' PHE . 3.4 mm? -78.48 114.1 17.09 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-O 121.453 0.644 . . . . 2.01 109.587 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.475 ' HG2' HG23 ' A' ' 70' ' ' THR . 40.1 mtt180 -76.35 144.04 40.39 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.718 -1.128 . . . . 4.79 109.978 -172.028 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.611 ' HA ' HG12 ' A' ' 38' ' ' ILE . 44.1 m-85 -61.78 -41.9 98.3 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.369 -0.378 . . . . 0.43 110.993 -174.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -37.5 70.43 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.725 0.774 . . . . 2.79 110.338 176.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -81.09 -23.59 38.32 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.247 -0.888 . . . . 0.88 110.963 -174.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.611 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.2 pt -98.22 15.55 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.408 0.623 . . . . 1.25 111.788 177.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.32 36.9 38.06 Favored Glycine 0 C--O 1.226 -0.377 0 CA-C-N 115.823 -0.626 . . . . 0.66 113.967 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -113.0 127.58 56.27 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 122.305 -0.527 . . . . 1.67 111.356 177.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -86.05 145.37 27.1 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 106.304 -1.739 . . . . 1.06 106.304 172.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.531 ' O ' ' HG3' ' A' ' 46' ' ' MET . 34.1 p -52.55 -31.37 35.5 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 113.275 0.843 . . . . 1.52 113.275 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.69 -43.16 90.09 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.007 0.432 . . . . 2.24 110.108 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -64.32 -36.38 83.94 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 121.375 0.607 . . . . 1.13 109.392 175.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.575 ' O ' ' HB ' ' A' ' 48' ' ' THR . 50.6 tp -66.39 -40.14 89.49 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.3 -0.863 . . . . 1.15 111.621 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 42' ' ' SER . 60.6 mtt -64.5 -30.19 71.23 Favored 'General case' 0 C--O 1.207 -1.141 0 O-C-N 121.714 -0.616 . . . . 2.13 110.444 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.404 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 7.7 tp10 -61.65 -33.59 74.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 122.282 1.039 . . . . 1.88 108.742 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.575 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 55.8 m -67.92 -61.65 1.77 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.583 -1.644 . . . . 1.18 107.362 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -54.05 -34.54 60.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.319 -1.309 . . . . 1.02 111.026 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.15 -49.72 73.17 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 123.651 0.78 . . . . 1.12 111.896 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.443 ' HA ' ' OG ' ' A' ' 54' ' ' SER . 92.8 mtt180 -67.3 -30.48 70.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.821 -0.627 . . . . 3.59 111.375 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.526 HD23 ' O ' ' A' ' 48' ' ' THR . 3.9 mm? -64.53 -46.59 82.23 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.47 -0.332 . . . . 1.61 110.198 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.567 ' HA ' HG13 ' A' ' 58' ' ' VAL . 44.4 mt-10 -57.09 -51.38 69.53 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 115.562 -0.745 . . . . 0.48 110.358 177.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.443 ' OG ' ' HA ' ' A' ' 51' ' ' ARG . 6.4 p -63.45 -52.46 61.34 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.501 0.926 . . . . 1.75 113.501 -178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.478 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 30.3 ttm180 -66.46 -49.84 65.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.809 0.67 . . . . 3.52 112.809 -177.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.478 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 99.6 m-85 -92.56 -17.36 24.53 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.056 0.762 . . . . 1.35 113.056 -170.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.15 68.14 1.44 Allowed Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.243 -0.979 . . . . 0.93 110.945 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.567 HG13 ' HA ' ' A' ' 53' ' ' GLU . 10.8 p -141.61 176.1 4.64 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 N-CA-C 108.066 -1.087 . . . . 1.72 108.066 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.468 ' H ' HG22 ' A' ' 58' ' ' VAL . 4.4 p -140.68 107.36 5.35 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.345 0.593 . . . . 2.39 109.996 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.451 HD11 ' HB2' ' A' ' 49' ' ' ALA . 61.6 mt -105.99 111.81 64.38 Favored Pre-proline 0 C--N 1.31 -1.109 0 CA-C-N 115.227 -0.897 . . . . 1.21 109.197 -176.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -59.58 130.13 34.06 Favored 'Trans proline' 0 C--O 1.25 1.076 0 C-N-CA 122.629 2.22 . . . . 1.09 111.515 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -51.18 -39.46 56.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.306 1.442 . . . . 1.83 111.961 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.42 -39.02 85.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.496 -0.32 . . . . 2.34 111.292 -177.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.22 -39.54 42.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 109.041 -0.726 . . . . 1.24 109.041 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -36.69 73.88 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.904 -0.589 . . . . 1.13 111.096 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -88.65 4.83 85.08 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.015 -0.612 . . . . 0.61 112.349 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -102.78 -25.21 13.6 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 122.779 -0.248 . . . . 4.72 111.271 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 m -72.71 105.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.835 0.826 . . . . 1.15 109.933 -178.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.435 ' OD2' ' HD3' ' A' ' 34' ' ' ARG . 34.1 t70 -87.44 -24.28 24.21 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 114.722 -1.126 . . . . 1.91 110.807 -176.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.475 HG23 ' HG2' ' A' ' 34' ' ' ARG . 31.9 p -123.96 138.93 31.44 Favored Pre-proline 0 N--CA 1.418 -2.053 0 CA-C-N 115.685 -0.689 . . . . 1.16 110.705 -178.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.838 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.2 Cg_exo -54.73 -34.16 83.23 Favored 'Trans proline' 0 CA--C 1.514 -0.509 0 C-N-CA 123.669 2.913 . . . . 0.36 112.812 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -51.8 -45.21 63.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 123.413 0.446 . . . . 1.84 111.966 175.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.38 -45.32 88.19 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 121.29 0.567 . . . . 2.13 110.483 178.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.05 -46.2 75.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.328 -0.851 . . . . 1.56 109.88 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.42 -46.08 83.93 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 116.216 -0.447 . . . . 1.12 109.803 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.11 -43.34 98.7 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.189 -0.914 . . . . 0.57 110.546 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.58 -52.28 66.08 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 123.568 0.747 . . . . 2.48 111.301 -177.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.7 mt -68.2 -46.62 80.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.558 0 C-N-CA 120.234 -0.586 . . . . 1.19 110.62 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.434 ' OD1' ' HB3' ' A' ' 4' ' ' LEU . 17.1 m-80 -55.99 -42.54 76.51 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 120.61 0.243 . . . . 1.14 110.575 177.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.12 -46.38 65.69 Favored Glycine 0 C--N 1.321 -0.304 0 CA-C-N 116.303 -0.408 . . . . 0.53 112.624 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.24 -35.91 80.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.705 0.288 . . . . 1.22 110.565 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.06 -39.45 79.12 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.376 -0.374 . . . . 1.97 111.138 176.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.233 -0.44 . . . . 1.26 110.669 177.816 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.424 HD11 ' HA ' ' A' ' 79' ' ' ASN . 25.7 tp . . . . . 0 N--CA 1.398 -3.031 0 CA-C-O 121.093 0.473 . . . . 1.89 109.805 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.7 mt -92.52 128.48 38.39 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-N 115.855 -0.611 . . . . 1.38 111.051 -176.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.6 p -97.8 -176.35 3.44 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.409 -1.7 . . . . 1.29 106.409 168.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.4 m -57.81 -36.19 71.88 Favored 'General case' 0 C--N 1.312 -1.022 0 O-C-N 123.039 0.212 . . . . 1.31 110.626 174.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.509 ' O ' ' HB3' ' A' ' 11' ' ' ARG . 25.6 t70 -78.53 -32.71 48.09 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.076 0.465 . . . . 1.65 111.069 -177.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.46 -42.78 87.07 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.97 -0.752 . . . . 1.41 108.97 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.681 HD11 HD21 ' A' ' 74' ' ' LEU . 13.9 tp -66.54 -41.69 88.34 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.729 -1.123 . . . . 1.23 108.667 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.509 ' HB3' ' O ' ' A' ' 8' ' ' ASP . 72.6 ttt180 -48.32 -58.48 4.53 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.203 1.401 . . . . 3.04 111.601 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.519 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 62.3 mtp180 -58.18 -36.44 73.06 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 112.498 0.555 . . . . 4.47 112.498 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -45.2 95.3 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 123.377 0.423 . . . . 1.19 109.905 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.93 -42.36 90.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.344 -0.389 . . . . 2.05 111.799 177.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.416 HG21 ' O ' ' A' ' 11' ' ' ARG . 90.6 t -54.54 -51.71 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 121.029 0.442 . . . . 1.33 110.221 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 13.7 mm-40 -63.72 -32.61 74.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.505 -0.77 . . . . 2.05 112.522 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p . . . . . 0 C--N 1.317 -0.836 0 N-CA-C 112.745 0.646 . . . . 1.66 112.745 -175.544 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 . . . . . 0 CA--C 1.499 -0.994 0 N-CA-C 109.925 -0.398 . . . . 2.07 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -136.4 15.16 3.21 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.261 0.553 . . . . 0.51 110.075 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.62 HD22 ' HB2' ' A' ' 71' ' ' PRO . 60.1 mt -53.48 -24.16 12.25 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.183 1.549 . . . . 1.12 115.183 -177.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -95.36 -3.34 47.35 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.387 0.514 . . . . 2.04 112.387 -178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.468 ' O ' ' HD3' ' A' ' 71' ' ' PRO . 8.9 mp -80.63 138.81 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.394 -0.367 . . . . 2.01 110.698 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.11 141.37 35.83 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 109.785 -0.45 . . . . 4.79 109.785 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.452 ' HA ' HG12 ' A' ' 38' ' ' ILE . 50.4 m-85 -68.27 -42.91 78.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.362 0.601 . . . . 0.43 109.468 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.454 ' H ' ' CD ' ' A' ' 36' ' ' GLU . 1.5 mp0 -54.67 -34.96 63.04 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 124.655 1.182 . . . . 2.79 109.921 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -79.32 -31.39 43.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.564 -1.198 . . . . 0.88 111.124 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.533 HG13 ' CD1' ' A' ' 40' ' ' TYR . 31.0 pt -93.21 15.78 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 120.485 -0.486 . . . . 1.25 111.572 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.19 34.36 17.76 Favored Glycine 0 C--O 1.238 0.382 0 CA-C-N 115.732 -0.667 . . . . 0.66 114.127 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.533 ' CD1' HG13 ' A' ' 38' ' ' ILE . 9.1 m-85 -116.45 123.16 46.82 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 122.598 -0.354 . . . . 1.67 111.264 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.09 151.16 24.35 Favored 'General case' 0 CA--C 1.48 -1.726 0 N-CA-C 106.439 -1.689 . . . . 1.06 106.439 171.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.3 p -53.51 -34.63 58.81 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 113.076 0.769 . . . . 1.52 113.076 179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.71 -45.95 77.1 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 109.307 -0.627 . . . . 2.24 109.307 177.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.78 94.9 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.474 0.654 . . . . 1.13 109.846 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.592 HD22 HG22 ' A' ' 68' ' ' VAL . 56.7 tp -62.19 -40.16 95.15 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.686 -1.143 . . . . 1.15 110.175 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 81.9 mtp -63.99 -33.15 75.09 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.213 -0.449 . . . . 2.13 111.489 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.91 -29.3 70.23 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.492 0.663 . . . . 1.88 109.995 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.412 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 24.7 m -64.8 -61.86 1.92 Allowed 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.912 -1.514 . . . . 1.18 106.912 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.2 -36.06 70.39 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.776 -1.556 . . . . 1.02 110.655 177.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.5 -45.9 87.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.19 0.596 . . . . 1.12 111.96 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.53 -37.52 86.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.852 -0.613 . . . . 3.59 110.222 177.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 96.7 mt -64.38 -43.08 95.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.194 -0.457 . . . . 1.61 110.667 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 40.4 mt-10 -57.0 -54.05 51.16 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 109.936 -0.394 . . . . 0.48 109.936 175.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.4 m -61.55 -39.7 92.05 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.912 -1.04 . . . . 1.75 111.783 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.495 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 32.1 ttm180 -67.53 -50.55 58.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.27 -0.423 . . . . 3.52 111.733 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.495 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 89.9 m-85 -96.92 -22.91 16.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.691 1.367 . . . . 1.35 114.691 -171.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.63 21.66 33.58 Favored Glycine 0 C--N 1.306 -1.113 0 C-N-CA 119.937 -1.125 . . . . 0.93 112.461 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.02 137.41 26.55 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 N-CA-C 108.645 -0.872 . . . . 1.72 108.645 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.0 m -98.34 113.23 25.13 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.044 0.449 . . . . 2.39 110.866 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.6 mt -99.35 125.24 41.94 Favored Pre-proline 0 C--N 1.31 -1.125 0 CA-C-N 116.251 -0.432 . . . . 1.21 110.026 -178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -62.77 116.01 3.28 Favored 'Trans proline' 0 C--O 1.243 0.74 0 C-N-CA 122.2 1.933 . . . . 1.09 110.044 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -55.24 -24.25 26.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.92 0.888 . . . . 1.83 113.059 -177.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.84 -43.94 74.47 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.175 0.512 . . . . 2.34 110.007 176.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 32.6 t -74.55 -34.71 36.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 109.142 -0.688 . . . . 1.24 109.142 -177.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.7 -24.5 61.52 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.726 -0.67 . . . . 1.13 111.976 178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -0.11 48.36 Favored Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.548 -0.834 . . . . 0.61 112.449 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -100.62 -12.81 18.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.184 0.516 . . . . 4.72 110.606 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.592 HG22 HD22 ' A' ' 45' ' ' LEU . 19.0 m -74.04 115.96 15.84 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.296 0 CA-C-O 121.635 0.731 . . . . 1.15 110.576 -177.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.98 -49.85 6.53 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 114.637 -1.165 . . . . 1.91 109.701 -176.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.522 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 26.5 p -118.15 157.31 49.18 Favored Pre-proline 0 N--CA 1.406 -2.671 0 CA-C-N 114.775 -1.102 . . . . 1.16 109.314 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.62 ' HB2' HD22 ' A' ' 31' ' ' LEU . 49.2 Cg_exo -58.49 -27.28 81.59 Favored 'Trans proline' 0 CA--C 1.5 -1.202 0 C-N-CA 123.591 2.861 . . . . 0.36 112.657 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -52.97 -48.64 67.27 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.602 0.564 . . . . 1.84 110.002 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.68 -47.61 80.53 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 114.626 -1.17 . . . . 2.13 109.828 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.681 HD21 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -67.19 -50.27 61.6 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.853 -1.067 . . . . 1.56 110.144 -175.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 79' ' ' ASN . 59.7 tp -55.85 -52.1 65.2 Favored 'General case' 0 C--O 1.206 -1.198 0 O-C-N 123.61 0.569 . . . . 1.12 110.389 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.04 -37.3 82.13 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 123.69 0.619 . . . . 0.57 112.03 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.98 -52.27 64.68 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.314 -0.403 . . . . 2.48 109.945 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.7 mt -70.67 -44.49 76.51 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.902 0 C-N-CA 120.223 -0.591 . . . . 1.19 109.932 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 75' ' ' LEU . 6.7 t-20 -49.52 -53.59 22.62 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 123.735 0.814 . . . . 1.14 110.755 -175.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.84 94.67 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.985 -0.626 . . . . 0.53 112.696 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.72 -33.94 73.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.12 0.486 . . . . 1.22 111.607 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 26.3 tp -78.68 -31.91 46.86 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 123.835 0.854 . . . . 1.97 110.051 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 121.569 0.7 . . . . 1.26 109.764 173.974 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.461 HD11 ' HA ' ' A' ' 79' ' ' ASN . 46.4 tp . . . . . 0 N--CA 1.402 -2.848 0 N-CA-C 107.326 -1.361 . . . . 1.89 107.326 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -84.11 122.45 28.83 Favored 'General case' 0 C--N 1.289 -2.056 0 C-N-CA 120.422 -0.511 . . . . 1.38 109.8 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.4 p -102.1 -173.92 2.45 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.239 -1.393 . . . . 1.29 107.239 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.9 m -58.36 -43.3 88.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.75 -0.833 . . . . 1.31 108.75 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.9 -47.1 87.96 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.76 -1.109 . . . . 1.65 110.943 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.27 -39.02 89.14 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 116.091 -0.504 . . . . 1.41 110.771 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.437 HD12 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -66.03 -41.59 90.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 1.23 110.02 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -53.31 -54.73 32.19 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.878 0.871 . . . . 3.04 109.634 175.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -58.72 -38.85 79.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.491 -1.231 . . . . 4.47 111.42 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.96 82.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.08 -0.509 . . . . 1.19 111.536 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.614 HD21 HG22 ' A' ' 48' ' ' THR . 94.8 mt -63.67 -44.58 93.32 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.219 0.533 . . . . 2.05 109.97 178.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.0 t -62.77 -50.62 79.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.395 -0.82 . . . . 1.33 109.103 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -59.72 -25.05 64.5 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 2.05 113.167 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.617 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 27.5 m . . . . . 0 C--N 1.301 -1.537 0 CA-C-O 120.81 0.338 . . . . 1.66 111.721 -178.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 CA--C 1.498 -1.035 0 N-CA-C 108.85 -0.796 . . . . 2.07 108.85 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -108.96 12.55 25.26 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 120.198 -0.601 . . . . 0.51 110.734 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 57.2 mt -51.45 -28.63 13.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.834 1.79 . . . . 1.12 115.834 -176.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -96.73 -6.79 35.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.489 0.661 . . . . 2.04 111.534 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.9 mp -79.82 129.68 34.69 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 121.875 -0.516 . . . . 2.01 110.122 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.76 137.78 39.51 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 109.455 -0.572 . . . . 4.79 109.455 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -58.54 -49.72 76.38 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 123.69 0.619 . . . . 0.43 110.23 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -57.28 -27.37 62.06 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.466 0.479 . . . . 2.79 111.697 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -81.74 -32.22 31.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.752 0.31 . . . . 0.88 110.315 -176.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.5 pt -93.72 23.18 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 112.224 0.453 . . . . 1.25 112.224 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 78.44 14.88 81.69 Favored Glycine 0 C--O 1.24 0.507 0 C-N-CA 121.118 -0.563 . . . . 0.66 113.855 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -103.36 125.77 50.16 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.007 0.432 . . . . 1.67 111.097 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -87.46 138.48 31.44 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 108.195 -1.039 . . . . 1.06 108.195 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.3 p -51.4 -33.09 28.74 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 123.718 0.636 . . . . 1.52 112.33 173.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.692 ' HA ' ' HE2' ' A' ' 46' ' ' MET . 7.2 tt -65.77 -48.66 71.07 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.199 -0.667 . . . . 2.24 109.199 177.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.21 -34.09 76.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.464 0.649 . . . . 1.13 109.949 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.448 ' O ' ' HB ' ' A' ' 48' ' ' THR . 64.2 tp -63.13 -33.49 75.57 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.0 -1.0 . . . . 1.15 111.188 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.692 ' HE2' ' HA ' ' A' ' 43' ' ' LEU . 69.9 mtm -64.24 -33.81 76.66 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.413 -0.515 . . . . 2.13 110.775 176.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.08 -34.05 77.49 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-O 121.631 0.729 . . . . 1.88 109.556 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.617 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 37.2 m -66.21 -57.51 7.43 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.843 -1.169 . . . . 1.18 107.843 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.527 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.5 -36.17 66.38 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 113.963 -1.471 . . . . 1.02 109.595 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.16 -44.4 87.9 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 123.085 0.554 . . . . 1.12 112.279 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 38.0 mtp180 -66.19 -34.24 77.59 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.382 0.611 . . . . 3.59 109.975 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 49' ' ' ALA . 94.5 mt -65.71 -44.9 84.7 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.575 -0.739 . . . . 1.61 109.977 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.601 ' HA ' HG11 ' A' ' 58' ' ' VAL . 47.2 mt-10 -58.1 -44.17 87.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.48 109.927 174.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -61.3 -59.63 5.0 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.496 -1.229 . . . . 1.75 110.817 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -66.12 -41.94 89.83 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.77 1.026 . . . . 3.52 113.77 -177.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -95.26 -17.88 21.32 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.97 1.1 . . . . 1.35 113.97 -172.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.21 65.79 1.89 Allowed Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.012 -1.09 . . . . 0.93 110.858 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.601 HG11 ' HA ' ' A' ' 53' ' ' GLU . 10.6 p -140.63 176.18 5.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 107.969 -1.123 . . . . 1.72 107.969 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.464 ' H ' HG21 ' A' ' 58' ' ' VAL . 22.2 p -140.96 105.47 4.87 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.594 0.711 . . . . 2.39 110.01 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.7 mt -96.9 122.5 56.47 Favored Pre-proline 0 C--N 1.291 -1.955 0 CA-C-N 115.738 -0.664 . . . . 1.21 109.543 -174.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.89 128.47 26.87 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.715 2.277 . . . . 1.09 111.531 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -52.97 -37.78 61.5 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.777 1.231 . . . . 1.83 111.435 -178.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.54 -40.98 85.02 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 115.088 -0.96 . . . . 2.34 110.492 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.7 HG12 ' HG ' ' A' ' 77' ' ' LEU . 61.4 t -74.54 -45.05 46.54 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.221 -0.659 . . . . 1.24 109.221 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.23 -36.89 66.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 1.13 111.861 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.73 22.66 34.92 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.302 -0.952 . . . . 0.61 112.782 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -135.03 4.66 3.26 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.821 0.82 . . . . 4.72 110.162 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 m -82.01 124.08 38.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.009 -0.737 . . . . 1.15 109.009 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.37 -40.09 13.82 Favored 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 120.993 -0.283 . . . . 1.91 111.641 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 33.3 p -119.55 151.32 51.54 Favored Pre-proline 0 N--CA 1.417 -2.085 0 O-C-N 123.324 0.39 . . . . 1.16 110.672 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.554 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 68.6 Cg_exo -55.38 -32.24 80.8 Favored 'Trans proline' 0 C--O 1.206 -1.079 0 C-N-CA 123.657 2.905 . . . . 0.36 112.097 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.0 ttm105 -52.28 -48.26 65.41 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.769 0.668 . . . . 1.84 110.154 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -63.78 -48.9 75.09 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.95 0.9 . . . . 2.13 110.949 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.437 HD12 HD12 ' A' ' 10' ' ' LEU . 3.3 tm? -66.48 -44.95 81.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.023 -0.99 . . . . 1.56 110.407 -176.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.7 tp -57.78 -47.22 83.18 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.135 0.574 . . . . 1.12 109.974 178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.2 -47.71 80.58 Favored 'General case' 0 CA--C 1.506 -0.734 0 O-C-N 123.822 0.701 . . . . 0.57 111.689 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.7 ' HG ' HG12 ' A' ' 64' ' ' VAL . 3.4 tm? -59.66 -48.89 79.88 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 124.011 0.82 . . . . 2.48 109.872 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.9 mt -69.24 -39.22 78.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 116.164 -0.471 . . . . 1.19 110.541 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.461 ' HA ' HD11 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -60.65 -43.46 97.58 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.917 -0.129 . . . . 1.14 111.098 177.492 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.79 -42.59 98.47 Favored Glycine 0 N--CA 1.448 -0.531 0 O-C-N 123.481 0.488 . . . . 0.53 111.924 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.88 -42.9 72.85 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.072 0.463 . . . . 1.22 110.716 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.14 -14.61 62.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.881 0.697 . . . . 1.97 112.881 179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.779 0 CA-C-O 121.468 0.652 . . . . 1.26 109.686 173.896 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.536 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 30.1 tp . . . . . 0 N--CA 1.419 -1.995 0 N-CA-C 105.059 -2.2 . . . . 1.89 105.059 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.536 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 88.5 mt -122.86 123.03 40.08 Favored 'General case' 0 C--N 1.284 -2.243 0 N-CA-C 108.251 -1.018 . . . . 1.38 108.251 173.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.0 p -101.54 -170.47 1.83 Allowed 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 107.841 -1.17 . . . . 1.29 107.841 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.527 HG23 ' HA ' ' A' ' 29' ' ' ASP . 3.3 m -54.58 -54.57 39.62 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 123.294 0.638 . . . . 1.31 111.407 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -73.08 -28.47 62.31 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.703 -0.399 . . . . 1.65 111.805 -176.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.88 -38.56 86.53 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 108.636 -0.875 . . . . 1.41 108.636 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.527 HD23 ' HB2' ' A' ' 75' ' ' LEU . 14.2 tp -66.48 -45.62 79.04 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.225 -0.898 . . . . 1.23 108.671 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.538 ' O ' HG21 ' A' ' 15' ' ' VAL . 2.5 tmt_? -50.62 -51.43 48.8 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.12 0.968 . . . . 3.04 109.709 175.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -57.72 -42.25 83.43 Favored 'General case' 0 C--N 1.313 -1.013 0 C-N-CA 124.824 1.249 . . . . 4.47 110.883 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.84 99.91 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 115.467 -0.788 . . . . 1.19 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.599 HD12 HG22 ' A' ' 48' ' ' THR . 11.1 mp -63.79 -41.64 97.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.98 -0.554 . . . . 2.05 111.133 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.538 HG21 ' O ' ' A' ' 11' ' ' ARG . 66.8 t -56.35 -55.98 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.526 -0.546 . . . . 1.33 109.526 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -54.91 -49.11 72.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.517 -0.765 . . . . 2.05 111.968 -178.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.479 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 4.0 m . . . . . 0 C--N 1.304 -1.374 0 N-CA-C 112.27 0.47 . . . . 1.66 112.27 -173.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.527 ' HA ' HG23 ' A' ' 7' ' ' THR . 16.3 t70 . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.15 0.5 . . . . 2.07 110.251 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -115.82 13.29 16.07 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.857 -0.61 . . . . 0.51 109.683 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.767 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 48.6 mt -51.66 -21.68 2.84 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.687 1.736 . . . . 1.12 115.687 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -90.74 -21.63 21.47 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.181 0.515 . . . . 2.04 111.531 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mp -77.86 117.92 19.68 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 116.079 -0.51 . . . . 2.01 110.084 -175.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -71.92 144.84 48.82 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.648 -0.871 . . . . 4.79 108.648 -176.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.49 ' HA ' HG12 ' A' ' 38' ' ' ILE . 66.9 m-85 -57.26 -45.69 83.76 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.37 0.508 . . . . 0.43 112.37 -175.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.8 -31.19 70.58 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.712 0.767 . . . . 2.79 111.37 178.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -81.54 -17.82 47.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.242 -0.89 . . . . 0.88 109.939 -175.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.49 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.1 pt -101.8 14.47 5.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.381 0.61 . . . . 1.25 111.622 173.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.4 18.71 77.62 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.636 -0.711 . . . . 0.66 114.153 175.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -98.84 128.15 44.97 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 122.422 -0.457 . . . . 1.67 111.788 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -88.72 151.05 22.66 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.991 -1.114 . . . . 1.06 107.991 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.553 ' O ' ' HG3' ' A' ' 46' ' ' MET . 60.7 p -53.99 -28.38 37.51 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.456 0.539 . . . . 1.52 112.456 175.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.63 -58.6 6.95 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.365 -0.606 . . . . 2.24 109.365 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.095 0.474 . . . . 1.13 110.577 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.488 ' O ' ' HB ' ' A' ' 48' ' ' THR . 57.6 tp -62.54 -45.18 94.14 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.523 -0.762 . . . . 1.15 110.818 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.553 ' HG3' ' O ' ' A' ' 42' ' ' SER . 61.7 mtt -63.65 -40.71 97.55 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.6 0.238 . . . . 2.13 110.544 177.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.07 -29.02 70.19 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.767 0.794 . . . . 1.88 111.055 177.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.599 HG22 HD12 ' A' ' 14' ' ' LEU . 92.3 m -65.91 -54.8 21.71 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.152 -1.425 . . . . 1.18 107.152 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.495 ' HA ' HD13 ' A' ' 52' ' ' LEU . . . -57.6 -33.79 68.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.816 -1.538 . . . . 1.02 110.73 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -57.33 -46.99 82.72 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.408 0.683 . . . . 1.12 112.275 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -64.63 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.369 0.604 . . . . 3.59 109.782 178.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 49' ' ' ALA . 83.0 mt -66.67 -43.25 85.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.416 -0.811 . . . . 1.61 110.221 177.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.5 mt-10 -55.18 -53.74 52.12 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.175 -0.676 . . . . 0.48 109.175 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -62.64 -42.54 99.66 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.062 -0.972 . . . . 1.75 112.609 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.06 -42.71 93.95 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.488 0.551 . . . . 3.52 112.488 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -96.4 -0.23 49.59 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 113.932 1.086 . . . . 1.35 113.932 -173.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 67.64 48.27 57.27 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 111.241 -0.744 . . . . 0.93 111.241 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.412 HG23 ' H ' ' A' ' 59' ' ' SER . 12.7 p -139.01 176.01 6.92 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 N-CA-C 107.612 -1.255 . . . . 1.72 107.612 -177.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.412 ' H ' HG23 ' A' ' 58' ' ' VAL . 16.2 t -142.17 143.41 32.95 Favored 'General case' 0 N--CA 1.421 -1.905 0 N-CA-C 108.808 -0.812 . . . . 2.39 108.808 175.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.478 HD12 ' HB3' ' A' ' 49' ' ' ALA . 64.6 mt -121.82 123.39 27.43 Favored Pre-proline 0 C--N 1.296 -1.735 0 N-CA-C 107.417 -1.327 . . . . 1.21 107.417 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.07 138.91 81.31 Favored 'Trans proline' 0 C--O 1.254 1.278 0 C-N-CA 122.356 2.038 . . . . 1.09 111.158 177.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -53.54 -38.69 64.04 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.877 0.871 . . . . 1.83 111.296 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.53 -33.88 75.96 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.407 -0.361 . . . . 2.34 111.247 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 81.2 t -73.1 -50.17 33.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 N-CA-C 108.083 -1.081 . . . . 1.24 108.083 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.62 -26.35 61.44 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.198 -0.91 . . . . 1.13 112.396 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.89 0.98 51.81 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.615 -0.802 . . . . 0.61 113.635 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -98.63 -16.3 19.12 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 117.779 0.789 . . . . 4.72 110.631 -178.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.515 HG21 HD21 ' A' ' 74' ' ' LEU . 23.1 m -74.41 113.44 12.86 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-N 115.508 -0.769 . . . . 1.15 109.81 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -89.66 -39.03 13.47 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-N 115.553 -0.748 . . . . 1.91 111.801 -177.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 37.3 p -115.65 150.77 45.33 Favored Pre-proline 0 N--CA 1.416 -2.134 0 CA-C-N 115.675 -0.693 . . . . 1.16 109.969 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.767 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.2 Cg_exo -53.99 -40.45 81.03 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.623 2.882 . . . . 0.36 114.502 -178.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -36.48 64.13 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.698 0.681 . . . . 1.84 111.677 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -62.6 -53.54 53.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.274 -0.639 . . . . 2.13 109.274 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.515 HD21 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -65.38 -46.43 80.12 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 1.56 110.051 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.527 ' HB2' HD23 ' A' ' 10' ' ' LEU . 43.4 tp -58.17 -52.82 63.97 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.077 -0.51 . . . . 1.12 111.064 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.93 -39.37 93.4 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.012 0.375 . . . . 0.57 112.012 -176.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.21 -42.54 99.4 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.645 0.26 . . . . 2.48 111.236 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.574 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.26 -43.23 65.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 110.022 -0.362 . . . . 1.19 110.022 178.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -52.61 -47.23 67.1 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.713 0.405 . . . . 1.14 111.328 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.31 -44.19 96.73 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.628 -0.589 . . . . 0.53 111.628 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.95 74.78 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 122.814 0.446 . . . . 1.22 111.07 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 78.6 mt -67.74 -39.36 84.25 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 122.754 0.422 . . . . 1.97 110.352 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.755 -0.657 . . . . 1.26 110.357 176.853 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.584 HD13 ' HB3' ' A' ' 82' ' ' LEU . 10.1 mp . . . . . 0 CA--C 1.486 -1.512 0 CA-C-O 121.538 0.685 . . . . 1.89 110.792 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.466 HD11 HD21 ' A' ' 52' ' ' LEU . 38.9 mt -89.56 126.37 35.58 Favored 'General case' 0 C--N 1.273 -2.723 0 CA-C-N 114.385 -1.28 . . . . 1.38 109.873 -173.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.5 p -99.42 -170.13 1.86 Allowed 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 107.06 -1.459 . . . . 1.29 107.06 169.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 m -52.37 -54.21 34.81 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 118.399 0.545 . . . . 1.31 111.385 -178.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -64.43 -41.81 96.37 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 116.163 -0.471 . . . . 1.65 111.71 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -65.47 -43.5 90.07 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 121.185 0.517 . . . . 1.41 110.046 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.726 HD12 HD22 ' A' ' 74' ' ' LEU . 40.9 tp -65.58 -44.4 86.81 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.393 -0.821 . . . . 1.23 109.776 -178.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.47 ' O ' HG21 ' A' ' 15' ' ' VAL . 36.9 ttm105 -52.29 -44.4 65.0 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.709 0.631 . . . . 3.04 110.93 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.577 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 75.9 ttt180 -56.37 -40.05 73.94 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.531 0.519 . . . . 4.47 111.192 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.31 -37.48 85.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.711 0.291 . . . . 1.19 110.524 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.547 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.53 -34.28 77.56 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.192 -0.458 . . . . 2.05 110.28 175.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 11' ' ' ARG . 28.3 t -73.13 -29.79 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.415 0.626 . . . . 1.33 109.826 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 22.2 mm-40 -61.16 -53.11 61.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.457 -0.792 . . . . 2.05 110.168 177.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.801 ' HG ' ' HH ' ' A' ' 40' ' ' TYR . 4.9 p . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 112.061 0.393 . . . . 1.66 112.061 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.2 t70 . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 121.335 0.588 . . . . 2.07 110.003 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.401 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 10.2 p90 -113.23 13.08 19.13 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.785 -0.643 . . . . 0.51 111.207 -175.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.66 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 38.5 mt -52.11 -25.23 8.34 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.608 1.707 . . . . 1.12 115.608 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -100.24 -10.26 21.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 2.04 111.121 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -79.97 119.79 23.29 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.805 -0.443 . . . . 2.01 109.805 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.89 151.1 38.97 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.161 -0.472 . . . . 4.79 109.862 -175.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.641 ' HA ' HG12 ' A' ' 38' ' ' ILE . 68.9 m-85 -68.53 -37.07 79.68 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 116.305 -0.407 . . . . 0.43 110.585 -176.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -57.85 -29.26 64.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.165 0.507 . . . . 2.79 110.969 175.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -83.11 -31.46 27.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.711 -0.677 . . . . 0.88 111.22 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.641 HG12 ' HA ' ' A' ' 35' ' ' PHE . 34.9 pt -93.84 24.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.185 0.517 . . . . 1.25 111.922 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 36.24 91.03 Favored Glycine 0 N--CA 1.453 -0.183 0 CA-C-N 115.292 -0.867 . . . . 0.66 113.582 176.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.801 ' HH ' ' HG ' ' A' ' 17' ' ' SER . 0.6 OUTLIER -114.53 122.17 45.74 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.182 0.515 . . . . 1.67 112.129 179.61 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.72 148.72 24.62 Favored 'General case' 0 CA--C 1.485 -1.552 0 N-CA-C 107.821 -1.177 . . . . 1.06 107.821 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 46' ' ' MET . 31.1 p -54.75 -33.99 61.96 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 113.556 0.946 . . . . 1.52 113.556 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.699 ' HA ' ' HE1' ' A' ' 46' ' ' MET . 6.8 tt -66.38 -45.24 80.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.066 -0.716 . . . . 2.24 109.066 178.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.41 87.49 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.099 -0.501 . . . . 1.13 110.043 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.6 tp -62.9 -39.36 94.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.273 -0.876 . . . . 1.15 111.185 178.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.699 ' HE1' ' HA ' ' A' ' 43' ' ' LEU . 65.5 mtm -64.08 -31.27 72.4 Favored 'General case' 0 C--O 1.199 -1.596 0 C-N-CA 120.66 -0.416 . . . . 2.13 110.969 177.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.55 -34.28 77.87 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.521 0.677 . . . . 1.88 110.191 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.547 HG21 HD13 ' A' ' 14' ' ' LEU . 35.8 m -64.12 -59.47 4.4 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 106.859 -1.534 . . . . 1.18 106.859 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.31 -38.08 70.78 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.05 -1.432 . . . . 1.02 110.16 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.0 80.84 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.242 0.617 . . . . 1.12 112.533 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -64.45 -36.39 84.0 Favored 'General case' 0 C--O 1.226 -0.171 0 N-CA-C 109.618 -0.512 . . . . 3.59 109.618 179.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.466 HD21 HD11 ' A' ' 5' ' ' LEU . 83.8 mt -64.97 -45.4 85.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.75 -0.659 . . . . 1.61 111.181 176.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 43.9 mt-10 -56.27 -50.53 71.11 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 122.845 0.458 . . . . 0.48 109.881 176.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -61.82 -43.21 99.31 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.68 -1.146 . . . . 1.75 110.095 -177.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.462 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 31.3 ttm180 -65.94 -52.39 50.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.334 -0.394 . . . . 3.52 111.902 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.462 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 85.3 m-85 -92.97 -17.55 23.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.376 1.251 . . . . 1.35 114.376 -170.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.8 53.11 4.71 Favored Glycine 0 C--N 1.312 -0.75 0 C-N-CA 119.99 -1.1 . . . . 0.93 110.762 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.09 140.66 43.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 N-CA-C 108.544 -0.909 . . . . 1.72 108.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 p -93.78 115.13 27.52 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 112.194 0.442 . . . . 2.39 112.194 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.2 mt -104.42 118.05 57.65 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.553 -0.906 . . . . 1.21 108.553 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -57.53 123.35 13.57 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.594 2.196 . . . . 1.09 111.313 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -50.38 -47.82 56.11 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.488 1.115 . . . . 1.83 113.692 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.31 -32.69 70.55 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 120.885 0.374 . . . . 2.34 110.641 -176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.26 -41.11 57.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 108.584 -0.895 . . . . 1.24 108.584 179.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.28 -33.96 68.17 Favored 'General case' 0 C--O 1.214 -0.78 0 C-N-CA 123.712 0.805 . . . . 1.13 111.589 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -90.41 -17.01 54.32 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.434 -0.889 . . . . 0.61 112.76 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -101.57 7.36 42.28 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.587 0.958 . . . . 4.72 113.587 -177.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.7 m -77.3 114.22 17.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 106.904 -1.517 . . . . 1.15 106.904 171.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -90.36 -34.69 15.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 121.619 0.723 . . . . 1.91 110.527 -173.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 67.9 p -117.42 142.52 30.45 Favored Pre-proline 0 N--CA 1.411 -2.423 0 CA-C-N 115.343 -0.844 . . . . 1.16 109.961 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.66 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 76.9 Cg_exo -55.5 -28.9 66.72 Favored 'Trans proline' 0 CA--C 1.499 -1.24 0 C-N-CA 123.866 3.044 . . . . 0.36 111.946 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -50.3 -51.71 42.85 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 124.425 1.078 . . . . 1.84 109.668 174.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -65.67 -42.48 91.26 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 115.101 -0.954 . . . . 2.13 111.249 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.726 HD22 HD12 ' A' ' 10' ' ' LEU . 5.0 tt -66.49 -44.07 83.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.964 -0.754 . . . . 1.56 108.964 -177.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -56.98 -51.86 67.54 Favored 'General case' 0 C--O 1.245 0.854 0 C-N-CA 123.525 0.73 . . . . 1.12 109.226 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.35 -44.07 92.72 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.813 -1.085 . . . . 0.57 111.407 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.7 tp -57.85 -50.06 74.59 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.751 0.82 . . . . 2.48 111.341 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.7 mt -70.55 -40.29 77.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.393 -0.523 . . . . 1.19 110.724 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.424 ' OD1' HD23 ' A' ' 4' ' ' LEU . 13.8 m-80 -60.99 -39.63 90.4 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.48 0.181 . . . . 1.14 110.745 177.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.85 -39.78 64.67 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.314 -0.469 . . . . 0.53 112.445 178.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.65 -45.03 65.91 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.838 0.352 . . . . 1.22 110.936 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.584 ' HB3' HD13 ' A' ' 4' ' ' LEU . 21.5 mt -69.36 -15.5 63.33 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.402 0.681 . . . . 1.97 112.486 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.525 0 CA-C-O 121.526 0.679 . . . . 1.26 109.182 173.031 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.524 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 28.9 tp . . . . . 0 N--CA 1.405 -2.709 0 N-CA-C 106.227 -1.768 . . . . 1.89 106.227 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.524 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 85.9 mt -120.14 123.67 43.9 Favored 'General case' 0 N--CA 1.406 -2.665 0 N-CA-C 108.273 -1.01 . . . . 1.38 108.273 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.7 p -98.37 -179.87 4.49 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 106.585 -1.635 . . . . 1.29 106.585 172.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.737 HG23 ' HA ' ' A' ' 29' ' ' ASP . 20.6 m -59.47 -31.93 69.78 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 118.638 0.654 . . . . 1.31 110.505 175.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.24 -46.72 63.89 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.44 -0.578 . . . . 1.65 109.44 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -64.51 -39.54 93.96 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.589 -0.732 . . . . 1.41 109.527 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.543 HD12 HD12 ' A' ' 74' ' ' LEU . 15.0 tp -65.49 -51.38 60.48 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 114.893 -1.048 . . . . 1.23 109.195 -177.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -52.32 -40.65 62.15 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 3.04 111.766 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.539 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 60.6 ttt180 -54.3 -54.52 39.09 Favored 'General case' 0 C--O 1.24 0.577 0 O-C-N 123.549 0.531 . . . . 4.47 110.586 176.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.46 -39.13 89.76 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.536 -0.756 . . . . 1.19 111.547 -175.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.8 -50.99 68.84 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.162 0.288 . . . . 2.05 111.174 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.8 t -63.52 -34.72 69.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 CA-C-O 120.999 0.428 . . . . 1.33 111.46 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.539 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 95.6 mt-10 -63.22 -49.31 74.68 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.245 0.545 . . . . 2.05 111.218 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 p . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 115.473 -0.785 . . . . 1.66 112.889 -174.744 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.737 ' HA ' HG23 ' A' ' 7' ' ' THR . 10.2 m-20 . . . . . 0 CA--C 1.496 -1.115 0 N-CA-C 109.064 -0.717 . . . . 2.07 109.064 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -123.32 19.08 9.8 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.943 -0.762 . . . . 0.51 108.943 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.499 ' O ' ' HB ' ' A' ' 70' ' ' THR . 29.3 mt -53.63 -23.19 10.39 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.58 1.326 . . . . 1.12 114.58 -175.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -92.0 -22.53 19.93 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.894 0.378 . . . . 2.04 110.475 -176.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.59 114.09 16.08 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.824 -1.176 . . . . 2.01 107.824 -178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -75.72 146.74 39.87 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 120.128 -0.629 . . . . 4.79 109.631 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.532 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.5 m-85 -55.22 -40.88 71.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.993 -0.549 . . . . 0.43 111.424 -175.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.06 -34.78 63.87 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.814 -0.63 . . . . 2.79 111.724 178.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.2 -34.23 32.42 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.143 -0.481 . . . . 0.88 110.259 -174.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 pt -90.8 17.7 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 113.118 0.784 . . . . 1.25 113.118 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.81 14.47 67.47 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 114.564 0.586 . . . . 0.66 114.564 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.532 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 32.6 m-85 -101.33 115.17 29.88 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 120.796 0.331 . . . . 1.67 111.418 -179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -87.22 154.54 20.63 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.427 -1.694 . . . . 1.06 106.427 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.548 ' O ' ' HG3' ' A' ' 46' ' ' MET . 44.1 p -51.44 -27.88 11.46 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 113.509 0.929 . . . . 1.52 113.509 177.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.565 ' HA ' ' HE1' ' A' ' 46' ' ' MET . 3.0 tm? -64.35 -57.76 8.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.162 -0.681 . . . . 2.24 109.162 177.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.68 78.25 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.23 0.538 . . . . 1.13 110.391 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.69 -33.6 75.4 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.121 -0.945 . . . . 1.15 110.95 179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.565 ' HE1' ' HA ' ' A' ' 43' ' ' LEU . 69.3 mtm -65.81 -29.76 70.29 Favored 'General case' 0 C--O 1.199 -1.559 0 C-N-CA 120.164 -0.615 . . . . 2.13 112.084 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 36.2 tt0 -65.79 -29.12 69.56 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.803 0.811 . . . . 1.88 109.505 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 24.6 m -64.62 -58.01 7.5 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 106.193 -1.78 . . . . 1.18 106.193 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.33 -38.44 74.11 Favored 'General case' 0 C--O 1.2 -1.523 0 CA-C-N 113.875 -1.512 . . . . 1.02 110.759 176.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.66 -45.31 81.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.531 0.732 . . . . 1.12 112.348 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.511 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 50.6 mtt180 -64.83 -38.63 91.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.744 -0.662 . . . . 3.59 109.572 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 86.7 mt -65.71 -41.39 92.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.055 -0.975 . . . . 1.61 110.271 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 37.7 mt-10 -57.0 -54.85 42.11 Favored 'General case' 0 CA--C 1.502 -0.885 0 O-C-N 123.624 0.577 . . . . 0.48 109.813 175.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.3 t -62.33 -38.5 89.7 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.501 -0.772 . . . . 1.75 111.928 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.497 ' CZ ' ' HH ' ' A' ' 56' ' ' TYR . 66.9 ttt180 -68.1 -51.02 51.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.693 0.627 . . . . 3.52 112.693 177.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.497 ' HH ' ' CZ ' ' A' ' 55' ' ' ARG . 65.0 m-85 -93.77 -12.38 29.25 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.749 1.018 . . . . 1.35 113.749 -171.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.63 17.94 79.45 Favored Glycine 0 C--N 1.308 -1.006 0 C-N-CA 120.698 -0.763 . . . . 0.93 111.285 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.442 HG11 ' HB2' ' A' ' 56' ' ' TYR . 7.5 p -98.38 135.06 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 N-CA-C 107.948 -1.13 . . . . 1.72 107.948 -178.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 m -92.87 118.45 31.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.997 -0.742 . . . . 2.39 108.997 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.1 mt -103.29 117.55 59.96 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.548 -0.908 . . . . 1.21 108.548 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.34 128.19 29.1 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.839 2.359 . . . . 1.09 110.977 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -51.28 -38.75 54.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.363 1.065 . . . . 1.83 111.943 -177.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.68 -45.31 79.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.901 -0.591 . . . . 2.34 110.652 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.99 -36.06 56.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 O-C-N 123.428 0.455 . . . . 1.24 109.879 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.48 -32.17 64.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.475 -0.784 . . . . 1.13 111.365 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.506 ' HA3' ' HB2' ' A' ' 42' ' ' SER . . . -116.98 23.13 10.15 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.5 -0.857 . . . . 0.61 112.297 178.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -101.15 -22.16 14.76 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.45 0.643 . . . . 4.72 110.334 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 74' ' ' LEU . 17.8 m -76.19 130.8 35.89 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 CA-C-N 114.984 -1.007 . . . . 1.15 111.594 -175.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.43 -50.09 6.78 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.706 -0.679 . . . . 1.91 111.343 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 32.2 p -109.13 149.23 39.4 Favored Pre-proline 0 N--CA 1.405 -2.701 0 CA-C-N 115.846 -0.615 . . . . 1.16 110.479 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.494 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 89.3 Cg_exo -51.82 -38.81 68.32 Favored 'Trans proline' 0 C--O 1.211 -0.831 0 C-N-CA 123.269 2.646 . . . . 0.36 112.228 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.42 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 13.6 ptt180 -55.63 -35.17 65.6 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.676 0.991 . . . . 1.84 113.676 176.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -63.78 -50.62 68.29 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.791 0.805 . . . . 2.13 109.137 176.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.543 HD12 HD12 ' A' ' 10' ' ' LEU . 3.4 tm? -66.57 -47.22 73.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.319 -1.31 . . . . 1.56 109.906 -176.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 51.4 tp -56.78 -48.77 77.12 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.646 0.778 . . . . 1.12 110.735 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.68 -44.05 82.82 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.346 -0.388 . . . . 0.57 111.52 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.11 -47.94 83.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.004 -0.544 . . . . 2.48 109.565 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.15 -35.21 52.44 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 C-N-CA 120.158 -0.617 . . . . 1.19 111.439 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.1 -44.02 82.8 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 117.969 0.35 . . . . 1.14 110.8 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.18 -43.33 98.77 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.541 -0.624 . . . . 0.53 111.541 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.58 -25.77 65.06 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.974 0.416 . . . . 1.22 111.271 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 66.6 mt -79.58 -40.66 28.9 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 116.207 -0.451 . . . . 1.97 110.513 177.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.62 0 CA-C-O 121.439 0.638 . . . . 1.26 110.174 177.29 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 tp . . . . . 0 N--CA 1.407 -2.6 0 CA-C-O 122.031 0.919 . . . . 1.89 112.498 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.421 HD22 ' CZ ' ' A' ' 56' ' ' TYR . 96.4 mt -101.66 131.34 47.94 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 114.419 -1.264 . . . . 1.38 108.941 176.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p -102.22 -176.44 3.12 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.963 -1.495 . . . . 1.29 106.963 170.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.702 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.0 m -58.14 -39.7 79.44 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 118.284 0.493 . . . . 1.31 111.371 177.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.84 -42.53 94.84 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.104 0.478 . . . . 1.65 110.05 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -67.89 -41.19 83.14 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.685 -0.689 . . . . 1.41 109.601 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.421 HD11 ' CD1' ' A' ' 74' ' ' LEU . 28.0 tp -64.82 -43.82 91.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.762 -1.108 . . . . 1.23 110.539 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -49.93 -41.74 46.92 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.471 0.708 . . . . 3.04 111.92 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.408 ' HG2' ' OE2' ' A' ' 16' ' ' GLU . 40.6 ttm180 -55.47 -43.76 75.8 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.915 0.76 . . . . 4.47 111.116 -177.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.466 ' HB1' HD21 ' A' ' 52' ' ' LEU . . . -63.68 -42.08 98.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.239 -0.437 . . . . 1.19 110.839 -178.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.588 HD13 HG23 ' A' ' 48' ' ' THR . 3.8 mm? -64.83 -37.06 86.34 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.358 -0.383 . . . . 2.05 110.519 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.64 -53.31 32.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 N-CA-C 109.937 -0.394 . . . . 1.33 109.937 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.408 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.9 mt-10 -58.97 -40.6 85.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.902 -0.59 . . . . 2.05 112.503 -177.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.9 p . . . . . 0 C--N 1.318 -0.792 0 C-N-CA 119.998 -0.681 . . . . 1.66 112.465 -179.423 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.702 ' HA ' HG21 ' A' ' 7' ' ' THR . 6.6 p-10 . . . . . 0 N--CA 1.433 -1.285 0 N-CA-C 108.591 -0.892 . . . . 2.07 108.591 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.32 19.49 15.51 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.49 0.662 . . . . 0.51 109.518 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.631 ' O ' ' HB ' ' A' ' 70' ' ' THR . 59.5 mt -51.98 -32.08 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 114.716 1.376 . . . . 1.12 114.716 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -94.73 -1.88 52.15 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.101 0.477 . . . . 2.04 112.007 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp -81.34 129.52 34.66 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.722 -0.844 . . . . 2.01 108.722 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 142.61 43.77 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 108.033 -1.099 . . . . 4.79 108.033 -177.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.552 ' HA ' HG12 ' A' ' 38' ' ' ILE . 73.2 m-85 -60.13 -41.8 93.45 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 120.546 -0.462 . . . . 0.43 109.8 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.25 -27.02 61.7 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.039 -0.528 . . . . 2.79 112.101 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.19 -34.47 37.39 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.651 -0.87 . . . . 0.88 108.651 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.552 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.8 pt -91.64 16.95 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.049 0.452 . . . . 1.25 110.803 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.84 55.77 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.55 -0.75 . . . . 0.66 113.701 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -118.09 108.93 15.82 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 113.156 0.798 . . . . 1.67 113.156 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.35 147.45 26.52 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 106.924 -1.51 . . . . 1.06 106.924 174.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.513 ' O ' ' HG3' ' A' ' 46' ' ' MET . 18.0 p -50.87 -31.04 16.14 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 114.237 1.199 . . . . 1.52 114.237 -178.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.769 ' HA ' ' HE1' ' A' ' 46' ' ' MET . 5.4 tt -63.77 -53.94 43.06 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.226 -1.028 . . . . 2.24 108.226 177.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.51 -35.24 79.83 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.29 0.567 . . . . 1.13 110.32 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.445 ' O ' ' HB ' ' A' ' 48' ' ' THR . 59.8 tp -61.57 -37.71 84.84 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.352 -0.84 . . . . 1.15 111.615 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.769 ' HE1' ' HA ' ' A' ' 43' ' ' LEU . 59.9 mtm -63.78 -33.4 75.57 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 120.735 -0.386 . . . . 2.13 110.657 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -66.78 -32.18 73.3 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 121.946 0.879 . . . . 1.88 109.805 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.588 HG23 HD13 ' A' ' 14' ' ' LEU . 55.6 m -66.52 -55.86 13.57 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.411 -1.329 . . . . 1.18 107.411 178.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.92 -38.21 69.97 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.72 -1.582 . . . . 1.02 109.855 177.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.85 80.26 Favored 'General case' 0 C--O 1.251 1.17 0 C-N-CA 123.099 0.56 . . . . 1.12 112.45 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 -66.31 -38.72 88.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.967 -0.561 . . . . 3.59 109.724 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.466 HD21 ' HB1' ' A' ' 13' ' ' ALA . 85.4 mt -63.98 -45.68 87.98 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.422 -0.808 . . . . 1.61 110.498 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.8 mt-10 -56.53 -49.6 74.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.83 -0.623 . . . . 0.48 110.084 176.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.2 t -62.37 -54.73 36.17 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.983 -1.008 . . . . 1.75 110.894 -177.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.91 -38.13 89.94 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.375 0.879 . . . . 3.52 113.375 -174.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.421 ' CZ ' HD22 ' A' ' 5' ' ' LEU . 99.4 m-85 -98.7 -9.52 24.5 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 114.504 1.298 . . . . 1.35 114.504 -173.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.42 50.58 8.11 Favored Glycine 0 C--N 1.316 -0.557 0 C-N-CA 120.278 -0.963 . . . . 0.93 111.792 178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.3 p -142.61 175.48 4.42 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 N-CA-C 106.96 -1.496 . . . . 1.72 106.96 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.6 t -142.22 139.34 31.97 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 119.19 0.905 . . . . 2.39 109.802 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.475 HD12 ' HB3' ' A' ' 49' ' ' ALA . 70.5 mt -114.1 129.46 24.79 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 108.043 -1.095 . . . . 1.21 108.043 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.73 113.98 2.21 Favored 'Trans proline' 0 C--O 1.245 0.844 0 C-N-CA 122.005 1.803 . . . . 1.09 109.742 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -55.49 -29.72 59.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.612 0.765 . . . . 1.83 113.004 -176.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -68.63 -41.03 80.02 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.823 -0.436 . . . . 2.34 109.823 178.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.2 t -75.17 -34.79 32.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.163 -0.68 . . . . 1.24 109.163 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.08 65.54 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.694 -0.685 . . . . 1.13 110.99 176.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -91.8 -3.74 68.1 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.591 -0.814 . . . . 0.61 112.76 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -101.37 -14.45 17.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.333 0.587 . . . . 4.72 110.829 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.4 m -76.17 124.25 33.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 CA-C-O 121.047 0.451 . . . . 1.15 109.904 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -92.29 -33.18 14.73 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 115.915 -0.584 . . . . 1.91 111.712 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.631 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 40.2 p -125.63 152.25 71.75 Favored Pre-proline 0 N--CA 1.418 -2.037 0 CA-C-N 115.645 -0.707 . . . . 1.16 110.085 -177.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . 0.577 ' HB2' HD22 ' A' ' 31' ' ' LEU . 54.2 Cg_exo -56.37 -26.3 61.73 Favored 'Trans proline' 0 C--O 1.2 -1.409 0 C-N-CA 123.57 2.846 . . . . 0.36 111.109 176.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -51.22 -57.21 9.4 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.84 0.856 . . . . 1.84 109.961 174.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -64.32 -41.11 96.99 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.463 -0.789 . . . . 2.13 110.885 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.421 ' CD1' HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -67.54 -46.17 73.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.47 -0.786 . . . . 1.56 110.691 -177.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.6 tp -57.6 -52.16 66.56 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.007 -0.738 . . . . 1.12 109.007 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -52.39 -44.6 65.43 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.811 1.244 . . . . 0.57 111.414 177.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 67.9 tp -62.38 -51.3 68.11 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.732 0.813 . . . . 2.48 111.197 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 58.8 mt -66.33 -39.75 84.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.165 -0.47 . . . . 1.19 110.119 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.95 -43.8 86.58 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.411 -0.359 . . . . 1.14 110.121 176.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.23 -42.7 97.8 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.575 -0.739 . . . . 0.53 112.003 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.84 79.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.757 0.313 . . . . 1.22 110.746 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.58 -36.65 84.39 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.647 0.379 . . . . 1.97 110.978 176.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.63 0 CA-C-N 116.069 -0.514 . . . . 1.26 110.6 176.168 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mtp . . . . . 0 CA--C 1.506 -0.747 0 N-CA-C 107.458 -1.312 . . . . 6.86 107.458 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.16 -39.27 66.39 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.487 -0.931 . . . . 4.54 108.487 174.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.518 ' O ' ' HB3' ' A' ' 82' ' ' LEU . 1.9 p -73.08 108.29 5.9 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-N 113.79 -1.55 . . . . 3.27 108.806 173.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.6 tp -158.33 152.19 23.72 Favored 'General case' 0 N--CA 1.389 -3.509 0 CA-C-N 114.756 -1.111 . . . . 1.89 108.636 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.501 HD22 ' CE2' ' A' ' 56' ' ' TYR . 88.7 mt -116.19 130.91 57.02 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 108.193 -1.04 . . . . 1.38 108.193 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.3 p -102.02 -174.82 2.67 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 108.017 -1.105 . . . . 1.29 108.017 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.897 HG22 ' HA ' ' A' ' 29' ' ' ASP . 12.0 m -57.01 -45.71 82.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.02 0.438 . . . . 1.31 110.278 178.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 18.0 t70 -57.22 -45.17 84.12 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.861 0.864 . . . . 1.65 111.298 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -67.1 -39.66 86.75 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.367 0.603 . . . . 1.41 110.102 -179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 9.8 tp -65.94 -42.46 90.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.099 -0.955 . . . . 1.23 109.04 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.518 ' HG3' ' HB3' ' A' ' 26' ' ' LEU . 39.0 ttm180 -53.02 -48.74 67.33 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.135 -0.939 . . . . 3.04 109.518 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.562 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 48.3 mtt180 -54.03 -44.53 71.06 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.016 -0.993 . . . . 4.47 111.648 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.93 91.7 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.53 0.519 . . . . 1.19 110.719 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.425 HD12 HG21 ' A' ' 48' ' ' THR . 9.4 mp -67.3 -31.64 72.07 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.998 0.37 . . . . 2.05 111.998 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 11' ' ' ARG . 95.6 t -64.75 -48.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 N-CA-C 108.581 -0.896 . . . . 1.33 108.581 175.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 47.0 mt-10 -58.14 -48.03 81.49 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.623 -0.717 . . . . 2.05 110.991 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.9 p -73.78 -17.03 61.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.305 0.854 . . . . 1.66 113.305 -177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -86.82 -23.97 25.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.079 0.466 . . . . 1.58 110.281 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.43 -132.85 11.09 Favored Glycine 0 N--CA 1.434 -1.448 0 N-CA-C 111.48 -0.648 . . . . 2.32 111.48 177.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -85.29 92.49 8.45 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 121.359 0.6 . . . . 5.17 109.894 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -132.89 174.31 10.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 114.955 -1.021 . . . . 5.27 109.789 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -98.72 -15.78 19.23 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 107.763 -1.199 . . . . 4.5 107.763 176.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.69 6.17 56.4 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-N 114.937 -1.028 . . . . 3.06 111.197 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 74.3 p 40.34 -115.85 0.23 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.242 1.417 . . . . 3.17 114.361 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -104.22 20.12 18.93 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 115.356 -0.838 . . . . 3.23 112.026 -177.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.518 ' HB3' ' HG3' ' A' ' 11' ' ' ARG . 9.1 mp -81.65 2.9 27.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.01 0.434 . . . . 1.6 110.93 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.2 m -60.88 135.83 57.9 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 124.277 1.031 . . . . 1.86 110.175 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.13 -138.16 32.45 Favored Glycine 0 N--CA 1.434 -1.495 0 N-CA-C 110.917 -0.873 . . . . 1.11 110.917 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.897 ' HA ' HG22 ' A' ' 7' ' ' THR . 5.2 m-20 -92.05 113.62 25.94 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 109.521 -0.548 . . . . 2.07 109.521 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.7 p90 -109.0 14.13 24.24 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.093 -0.706 . . . . 0.51 109.093 178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.758 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 67.2 mt -53.54 -26.85 22.91 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 113.608 0.966 . . . . 1.12 113.608 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -95.11 -11.01 29.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.3 -0.409 . . . . 2.04 111.274 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp -82.05 116.25 21.56 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.659 -0.867 . . . . 2.01 108.659 175.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -75.7 149.89 37.99 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 115.287 -0.87 . . . . 4.79 110.426 -173.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HA ' HG12 ' A' ' 38' ' ' ILE . 56.7 m-85 -61.96 -39.84 93.52 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.423 -0.353 . . . . 0.43 111.097 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -58.01 -31.99 67.49 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.401 0.619 . . . . 2.79 111.137 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -82.37 -26.01 33.29 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.349 -0.841 . . . . 0.88 111.246 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.3 pt -98.07 14.42 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.097 0.475 . . . . 1.25 111.245 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.39 40.96 99.73 Favored Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.767 -0.651 . . . . 0.66 113.116 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.434 ' HB2' HG13 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -115.97 113.96 23.97 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.482 -0.562 . . . . 1.67 109.482 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -85.83 156.94 20.35 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.338 -0.616 . . . . 1.06 109.338 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 46' ' ' MET . 24.4 p -53.39 -33.75 54.99 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.108 0.781 . . . . 1.52 113.108 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.3 -49.13 70.66 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.927 -0.768 . . . . 2.24 108.927 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.51 96.62 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 109.605 -0.517 . . . . 1.13 109.605 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.448 HD21 HG21 ' A' ' 68' ' ' VAL . 63.8 tp -60.62 -41.65 95.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.995 -1.002 . . . . 1.15 111.223 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.8 mtp -61.68 -40.58 95.47 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-N 116.609 -0.269 . . . . 2.13 110.344 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.523 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 34.5 tt0 -65.42 -34.86 79.29 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.471 0.653 . . . . 1.88 110.511 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.425 HG21 HD12 ' A' ' 14' ' ' LEU . 60.1 m -64.03 -56.74 12.88 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 107.252 -1.388 . . . . 1.18 107.252 178.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.491 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.0 -36.27 70.21 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 113.923 -1.489 . . . . 1.02 109.995 176.546 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.516 ' HA ' ' OE1' ' A' ' 53' ' ' GLU . . . -58.68 -40.99 85.16 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.466 0.706 . . . . 1.12 112.414 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.523 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 62.6 mtp85 -63.35 -42.32 98.9 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.376 -0.972 . . . . 3.59 108.376 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.32 -41.75 89.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.389 -1.278 . . . . 1.61 111.185 178.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.516 ' OE1' ' HA ' ' A' ' 50' ' ' ALA . 50.2 mt-10 -55.81 -53.2 59.57 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 123.262 0.625 . . . . 0.48 109.836 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.8 m -62.49 -46.62 87.61 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 114.938 -1.028 . . . . 1.75 111.357 -178.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -65.46 -45.78 82.43 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.7 -0.682 . . . . 3.52 112.373 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.501 ' CE2' HD22 ' A' ' 5' ' ' LEU . 94.0 m-85 -97.19 6.37 48.55 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.179 0.807 . . . . 1.35 113.179 -175.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.29 52.72 49.82 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 115.984 -0.553 . . . . 0.93 112.188 177.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.513 HG12 HD13 ' A' ' 82' ' ' LEU . 28.6 m -132.86 176.52 8.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.665 -0.494 . . . . 1.72 109.665 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 t -141.9 129.62 21.62 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.95 -1.13 . . . . 2.39 107.95 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.482 HD11 ' HB3' ' A' ' 49' ' ' ALA . 92.9 mt -106.93 124.19 36.16 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.926 -0.579 . . . . 1.21 109.513 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 126.5 21.73 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.048 2.499 . . . . 1.09 111.719 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -52.99 -30.75 36.99 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.809 1.244 . . . . 1.83 113.43 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 11.4 t70 -69.82 -47.65 61.99 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.276 -0.639 . . . . 2.34 109.276 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -72.4 -33.25 45.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.495 -0.775 . . . . 1.24 110.618 -174.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.69 -27.42 62.89 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.862 -0.608 . . . . 1.13 111.443 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.85 19.43 8.91 Favored Glycine 0 N--CA 1.434 -1.455 0 N-CA-C 111.06 -0.816 . . . . 0.61 111.06 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 14.5 tpp180 -100.9 -19.27 15.98 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.254 -0.647 . . . . 4.72 109.254 -178.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.452 HG23 ' HB2' ' A' ' 74' ' ' LEU . 30.2 m -79.05 123.7 36.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-N 115.04 -0.982 . . . . 1.15 111.615 -177.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -91.71 -31.78 15.68 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.279 -0.873 . . . . 1.91 110.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 21.5 p -125.22 145.25 50.02 Favored Pre-proline 0 N--CA 1.418 -2.034 0 CA-C-N 115.337 -0.847 . . . . 1.16 110.395 -176.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.758 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 77.1 Cg_exo -54.03 -32.1 67.24 Favored 'Trans proline' 0 C--O 1.215 -0.648 0 C-N-CA 123.732 2.954 . . . . 0.36 113.192 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -52.9 -43.38 66.14 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.222 0.326 . . . . 1.84 111.774 176.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -64.55 -48.05 76.51 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.595 0.758 . . . . 2.13 109.978 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.452 ' HB2' HG23 ' A' ' 68' ' ' VAL . 3.4 tm? -66.4 -42.09 88.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.925 -1.034 . . . . 1.56 110.114 -176.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.07 -52.31 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.552 -0.536 . . . . 1.12 109.552 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.7 -43.32 94.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.5 -0.773 . . . . 0.57 111.763 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.61 -46.9 87.58 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 109.781 -0.451 . . . . 2.48 109.781 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.79 -35.42 55.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 C-N-CA 120.944 -0.302 . . . . 1.19 110.583 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -40.79 89.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 120.689 0.28 . . . . 1.14 110.47 175.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.01 -32.43 69.6 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.776 -0.647 . . . . 0.53 112.449 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.12 60.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.819 0.819 . . . . 1.22 109.641 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.518 ' HB3' ' O ' ' A' ' 3' ' ' THR . 8.5 mp -72.62 -6.7 46.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.075 -0.966 . . . . 1.97 111.724 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.02 -28.28 66.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.549 0.69 . . . . 1.26 109.904 170.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -108.56 -34.22 6.8 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.562 -0.745 . . . . 2.44 111.679 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -107.3 140.44 40.21 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.307 0.575 . . . . 2.12 112.072 -176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.442 ' HA ' HG23 ' A' ' 3' ' ' THR . . . . . . . . 0 N--CA 1.429 -1.52 0 N-CA-C 108.291 -1.003 . . . . 3.84 108.291 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.442 ' HG2' ' HA ' ' A' ' 86' ' ' ALA . 66.4 mtt . . . . . 0 CA--C 1.506 -0.713 0 N-CA-C 110.3 -0.259 . . . . 6.86 110.3 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.83 144.66 46.21 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.505 -0.554 . . . . 4.54 109.505 178.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 t -89.04 123.24 33.16 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 122.116 0.96 . . . . 3.27 109.772 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.15 151.99 29.78 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-N 113.585 -1.643 . . . . 1.89 110.714 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 52' ' ' LEU . 73.8 mt -98.9 133.27 43.42 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.604 -0.726 . . . . 1.38 110.024 -178.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 p -99.92 -176.6 3.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.457 -1.312 . . . . 1.29 107.457 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.656 HG21 ' HA ' ' A' ' 29' ' ' ASP . 16.7 m -57.64 -38.86 75.76 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.11 -0.7 . . . . 1.31 109.11 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -60.03 -47.43 85.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.781 -1.1 . . . . 1.65 111.272 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.22 -39.76 89.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.835 -0.621 . . . . 1.41 110.098 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 17.3 tp -65.08 -45.05 86.85 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.943 -1.026 . . . . 1.23 109.265 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.49 ' NE ' ' HA ' ' A' ' 27' ' ' SER . 36.8 ttm180 -50.75 -54.56 22.35 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 124.0 0.92 . . . . 3.04 109.914 177.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 23.3 ttp180 -56.05 -46.33 78.94 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.67 -1.15 . . . . 4.47 111.689 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.466 ' HB3' HD21 ' A' ' 52' ' ' LEU . . . -62.16 -40.65 96.7 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.367 0.417 . . . . 1.19 111.281 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.12 -38.65 91.82 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.634 0.254 . . . . 2.05 111.34 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.3 t -66.71 -47.59 82.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.857 -0.423 . . . . 1.33 109.857 178.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 45.9 mt-10 -59.37 -39.69 84.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.289 -0.414 . . . . 2.05 111.021 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.555 ' CB ' ' HA ' ' A' ' 48' ' ' THR . 20.6 m -75.27 -15.79 60.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.302 0.573 . . . . 1.66 112.114 -178.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.3 -6.72 49.76 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.551 -0.907 . . . . 1.58 108.551 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.24 -97.19 1.66 Allowed Glycine 0 N--CA 1.429 -1.775 0 N-CA-C 108.942 -1.663 . . . . 2.32 108.942 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -162.28 93.23 0.85 Allowed 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 106.837 -1.542 . . . . 5.17 106.837 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -115.42 -85.75 0.61 Allowed 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 115.345 -0.843 . . . . 5.27 109.17 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -114.99 -53.78 2.61 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 108.834 -0.802 . . . . 4.5 108.834 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.79 -22.37 21.93 Favored Glycine 0 C--O 1.242 0.603 0 CA-C-N 116.012 -0.54 . . . . 3.06 113.551 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.5 p 53.24 -169.01 0.05 OUTLIER 'General case' 0 C--O 1.249 1.064 0 C-N-CA 125.734 1.614 . . . . 3.17 112.629 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -97.38 83.13 3.23 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 105.328 -2.101 . . . . 3.23 105.328 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.8 tp -101.18 -1.84 32.85 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.745 -1.116 . . . . 1.6 109.342 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.49 ' HA ' ' NE ' ' A' ' 11' ' ' ARG . 19.8 m -69.09 143.69 54.14 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.874 -1.057 . . . . 1.86 109.714 178.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.54 -161.56 19.67 Favored Glycine 0 N--CA 1.422 -2.247 0 N-CA-C 109.168 -1.573 . . . . 1.11 109.168 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.656 ' HA ' HG21 ' A' ' 7' ' ' THR . 19.9 t70 -97.5 106.14 18.4 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.609 -0.885 . . . . 2.07 108.609 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.405 ' HB2' HD13 ' A' ' 33' ' ' LEU . 25.1 p90 -101.32 14.92 30.47 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.431 -0.35 . . . . 0.51 111.624 -175.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.707 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 41.0 mt -52.75 -25.62 11.72 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.919 1.451 . . . . 1.12 114.919 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -92.19 -16.94 25.56 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.945 0.402 . . . . 2.04 111.315 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD13 ' HB2' ' A' ' 30' ' ' PHE . 81.2 mt -77.53 114.78 16.72 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 121.308 0.575 . . . . 2.01 109.735 -176.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 46.1 mtp180 -72.64 141.01 48.31 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.19 -0.914 . . . . 4.79 109.903 -172.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.493 ' HA ' HG12 ' A' ' 38' ' ' ILE . 38.9 m-85 -60.69 -39.35 88.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.501 -0.318 . . . . 0.43 110.258 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -56.7 -31.78 64.83 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.517 0.727 . . . . 2.79 111.142 177.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -82.65 -34.34 27.52 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.087 -0.506 . . . . 0.88 110.91 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.493 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.1 pt -90.79 9.71 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 112.511 0.56 . . . . 1.25 112.511 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.51 29.88 31.63 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.639 -0.709 . . . . 0.66 114.401 174.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.476 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 8.6 m-85 -111.59 121.46 45.21 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 117.25 0.525 . . . . 1.67 111.271 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -84.65 152.62 23.66 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 107.093 -1.447 . . . . 1.06 107.093 173.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 46' ' ' MET . 13.5 p -54.27 -30.44 50.57 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.914 0.709 . . . . 1.52 112.914 176.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.33 -52.37 54.32 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.08 -0.711 . . . . 2.24 109.08 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.26 -33.04 74.63 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.372 0.606 . . . . 1.13 110.247 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.526 ' O ' ' HB ' ' A' ' 48' ' ' THR . 44.8 tp -63.48 -46.73 84.81 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.51 -0.768 . . . . 1.15 110.199 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.44 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.8 mtm -63.92 -33.95 76.87 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.392 -0.367 . . . . 2.13 111.129 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.9 -33.48 75.41 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 121.957 0.884 . . . . 1.88 109.032 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.555 ' HA ' ' CB ' ' A' ' 17' ' ' SER . 86.5 m -68.99 -62.21 1.47 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.747 -1.115 . . . . 1.18 108.845 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.408 ' HB3' ' CD1' ' A' ' 60' ' ' ILE . . . -56.77 -25.32 54.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.912 -1.04 . . . . 1.02 111.575 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -43.65 84.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 123.288 0.635 . . . . 1.12 110.668 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -66.38 -37.41 85.21 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.108 -0.951 . . . . 3.59 110.769 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.52 HD12 HD11 ' A' ' 5' ' ' LEU . 3.9 mm? -62.66 -43.7 98.14 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 122.315 0.246 . . . . 1.61 110.431 177.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -58.0 -48.15 80.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 123.67 0.606 . . . . 0.48 110.638 175.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 m -63.4 -53.96 44.25 Favored 'General case' 0 CA--C 1.559 1.29 0 CA-C-O 121.196 0.522 . . . . 1.75 112.282 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -62.3 -38.04 87.87 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.948 0.899 . . . . 3.52 112.938 -174.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -102.29 -1.24 31.49 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 114.098 1.148 . . . . 1.35 114.098 -177.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.79 52.14 52.58 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 111.195 -0.762 . . . . 0.93 111.195 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.542 HG23 ' H ' ' A' ' 59' ' ' SER . 7.4 p -136.18 178.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 108.287 -1.005 . . . . 1.72 108.287 -174.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.542 ' H ' HG23 ' A' ' 58' ' ' VAL . 7.0 p -138.59 137.33 36.87 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-O 121.032 0.444 . . . . 2.39 109.977 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.408 ' CD1' ' HB3' ' A' ' 49' ' ' ALA . 87.2 mt -113.53 132.74 22.39 Favored Pre-proline 0 C--N 1.293 -1.881 0 N-CA-C 108.628 -0.878 . . . . 1.21 108.628 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -61.71 123.36 12.53 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 122.196 1.93 . . . . 1.09 111.012 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -53.42 -31.74 46.6 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.315 1.046 . . . . 1.83 111.018 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.66 -49.16 69.63 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.853 -1.067 . . . . 2.34 111.04 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.7 HG11 ' HG ' ' A' ' 77' ' ' LEU . 40.9 t -72.88 -33.81 44.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 109.805 -0.443 . . . . 1.24 109.805 -176.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.413 ' HB1' ' HG2' ' A' ' 46' ' ' MET . . . -58.05 -24.43 58.35 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.979 0.733 . . . . 1.13 112.979 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.63 2.81 34.25 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.495 -0.86 . . . . 0.61 112.364 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -108.1 -9.54 15.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.298 0.481 . . . . 4.72 112.298 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.521 HG22 HD23 ' A' ' 45' ' ' LEU . 15.5 m -79.35 111.42 16.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 121.465 0.65 . . . . 1.15 111.448 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -91.87 -31.93 15.5 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-N 115.667 -0.697 . . . . 1.91 110.219 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.1 p -121.69 145.31 42.76 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 115.325 -0.852 . . . . 1.16 111.016 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.707 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 56.8 Cg_exo -55.83 -34.17 90.57 Favored 'Trans proline' 0 C--O 1.212 -0.78 0 C-N-CA 123.916 3.078 . . . . 0.36 113.214 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.412 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 3.5 ptp180 -51.8 -45.86 64.02 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.346 0.403 . . . . 1.84 111.804 176.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -64.54 -44.83 89.56 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.532 0.682 . . . . 2.13 110.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.84 -47.65 68.39 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.952 -1.022 . . . . 1.56 110.657 -177.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 40.8 tp -58.48 -51.77 68.45 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.635 0.374 . . . . 1.12 110.95 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -58.71 -38.54 78.53 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.324 0.39 . . . . 0.57 110.93 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.7 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -62.49 -49.81 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.444 -0.576 . . . . 2.48 109.444 178.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.6 mt -67.34 -36.87 77.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.455 -0.339 . . . . 1.19 110.248 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -61.79 -37.06 82.96 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.873 -0.418 . . . . 1.14 109.873 176.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.51 -37.13 78.15 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.68 -0.691 . . . . 0.53 111.944 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.19 -44.86 67.83 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.189 0.519 . . . . 1.22 109.957 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.8 mt -66.96 -20.55 65.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 1.97 111.692 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.01 -27.04 69.14 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.979 0.511 . . . . 1.26 110.898 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -93.0 -4.95 51.72 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.782 -0.644 . . . . 2.44 110.129 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.409 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -94.67 31.58 1.77 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.583 0.706 . . . . 2.12 110.2 -177.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.442 ' HA ' ' HG2' ' A' ' 1' ' ' MET . . . . . . . . 0 C--N 1.305 -1.34 0 N-CA-C 108.34 -0.985 . . . . 3.84 108.34 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 CA--C 1.506 -0.718 0 N-CA-C 109.098 -0.704 . . . . 6.86 109.098 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.58 -49.55 14.4 Favored 'General case' 0 N--CA 1.439 -0.993 0 N-CA-C 108.405 -0.961 . . . . 4.54 108.405 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.0 m -91.75 106.57 18.57 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 122.778 1.275 . . . . 3.27 109.021 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 29.8 tp -155.78 161.0 40.75 Favored 'General case' 0 N--CA 1.388 -3.55 0 N-CA-C 103.937 -2.616 . . . . 1.89 103.937 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.437 ' HG ' HD13 ' A' ' 82' ' ' LEU . 92.1 mt -89.53 123.05 33.28 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 108.82 -0.807 . . . . 1.38 108.82 178.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.7 p -101.87 -173.91 2.46 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 107.313 -1.365 . . . . 1.29 107.313 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.486 HG23 ' HA ' ' A' ' 29' ' ' ASP . 27.6 m -57.23 -42.47 81.45 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.153 -0.684 . . . . 1.31 109.153 173.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.28 -48.91 79.85 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.424 1.089 . . . . 1.65 110.821 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -68.79 -39.54 80.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 116.027 -0.533 . . . . 1.41 111.421 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 18.6 tp -67.01 -45.2 78.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.795 -0.638 . . . . 1.23 109.978 -177.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.518 ' HG3' ' HG ' ' A' ' 26' ' ' LEU . 43.8 ttp-105 -53.81 -45.78 70.91 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.559 -0.746 . . . . 3.04 109.882 177.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.555 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 66.9 mtp180 -55.84 -43.82 77.4 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.058 -0.974 . . . . 4.47 112.11 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.18 -45.43 94.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 123.73 0.644 . . . . 1.19 110.217 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 mp -65.52 -30.8 71.6 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.245 0.461 . . . . 2.05 112.245 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.473 HG21 ' O ' ' A' ' 11' ' ' ARG . 48.2 t -72.83 -34.69 47.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.156 -0.683 . . . . 1.33 109.156 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 44.2 mt-10 -66.19 -42.04 89.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.455 -0.338 . . . . 2.05 111.493 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.566 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 4.7 p -77.41 -42.02 37.77 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.896 1.073 . . . . 1.66 113.896 -177.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.43 -37.82 31.31 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 121.119 0.485 . . . . 1.58 110.785 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.06 178.05 44.73 Favored Glycine 0 N--CA 1.424 -2.15 0 N-CA-C 109.777 -1.329 . . . . 2.32 109.777 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.91 83.04 7.6 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.924 0.869 . . . . 5.17 110.085 177.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 38.4 p -79.93 -95.55 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.507 0 CA-C-N 114.796 -1.093 . . . . 5.27 109.591 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -87.39 -14.01 41.81 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.349 -1.352 . . . . 4.5 107.349 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.47 -25.04 29.47 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.431 -1.468 . . . . 3.06 109.431 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p 55.45 -175.42 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.597 1.959 . . . . 3.17 113.136 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -120.23 70.52 0.88 Allowed 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.136 -1.431 . . . . 3.23 107.136 171.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.518 ' HG ' ' HG3' ' A' ' 11' ' ' ARG . 15.1 tp -105.7 -17.14 14.48 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 113.598 -1.637 . . . . 1.6 107.904 -176.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.4 ' HA ' ' HD2' ' A' ' 11' ' ' ARG . 10.1 p -51.28 129.79 25.41 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 125.46 1.504 . . . . 1.86 112.881 -178.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.55 -116.24 4.58 Favored Glycine 0 N--CA 1.425 -2.087 0 CA-C-N 115.148 -0.933 . . . . 1.11 111.671 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.486 ' HA ' HG23 ' A' ' 7' ' ' THR . 3.8 m-20 -112.71 126.17 55.11 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.32 -0.993 . . . . 2.07 108.32 -175.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 14.9 p90 -128.86 11.81 6.15 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.734 -0.786 . . . . 0.51 111.348 -177.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.828 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 44.8 mt -53.02 -29.13 27.7 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.735 1.383 . . . . 1.12 114.735 -176.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -98.73 -6.08 30.18 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.964 0.411 . . . . 2.04 111.842 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.7 mp -82.33 124.51 30.05 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.807 -0.812 . . . . 2.01 108.807 178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -76.04 143.58 41.32 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 116.47 -0.332 . . . . 4.79 110.855 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.459 ' HA ' HG12 ' A' ' 38' ' ' ILE . 77.2 m-85 -63.68 -44.1 94.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.463 -0.335 . . . . 0.43 111.014 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -57.95 -26.23 61.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.085 0.469 . . . . 2.79 111.75 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.46 -30.45 27.22 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.168 -0.469 . . . . 0.88 110.681 -176.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.459 HG12 ' HA ' ' A' ' 35' ' ' PHE . 33.9 pt -92.32 19.05 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 121.122 0.487 . . . . 1.25 112.06 -176.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.41 34.3 54.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.047 -0.597 . . . . 0.66 112.011 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -116.19 118.71 33.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 121.467 0.651 . . . . 1.67 112.162 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -85.82 151.14 24.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 106.939 -1.504 . . . . 1.06 106.939 172.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.404 ' O ' ' HG3' ' A' ' 46' ' ' MET . 32.7 p -55.0 -32.27 61.66 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.342 0.497 . . . . 1.52 112.342 176.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 tt -63.92 -50.08 70.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.659 -0.867 . . . . 2.24 108.659 176.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.56 -38.81 88.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.901 -0.59 . . . . 1.13 109.789 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.524 HD21 HG22 ' A' ' 68' ' ' VAL . 57.7 tp -61.72 -46.41 89.77 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.329 -0.851 . . . . 1.15 110.334 177.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 42' ' ' SER . 73.1 mtm -62.56 -37.39 85.97 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 116.456 -0.338 . . . . 2.13 111.278 177.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 29.8 tt0 -63.83 -35.47 80.74 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.539 0.685 . . . . 1.88 110.285 176.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.8 m -65.6 -53.25 44.35 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.227 -1.397 . . . . 1.18 107.227 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.402 ' HB3' HD13 ' A' ' 60' ' ' ILE . . . -56.83 -38.63 72.89 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.19 -1.368 . . . . 1.02 110.033 175.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.92 -44.99 91.43 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 123.96 0.904 . . . . 1.12 112.061 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.566 ' CZ ' ' HA ' ' A' ' 17' ' ' SER . 53.2 mtt180 -62.68 -38.78 91.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.701 -0.851 . . . . 3.59 108.701 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 96.6 mt -65.87 -41.18 91.92 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.041 -0.981 . . . . 1.61 111.212 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -55.7 -55.32 33.54 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.086 -0.709 . . . . 0.48 109.086 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.8 m -62.42 -51.24 68.31 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.534 -1.212 . . . . 1.75 112.433 -177.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -65.77 -38.09 88.11 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.037 0.754 . . . . 3.52 113.037 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -100.29 3.63 43.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 114.121 1.156 . . . . 1.35 114.121 -175.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.27 52.16 51.5 Favored Glycine 0 N--CA 1.459 0.193 0 N-CA-C 111.501 -0.64 . . . . 0.93 111.501 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.447 HG21 ' H ' ' A' ' 59' ' ' SER . 8.6 p -141.57 177.41 3.43 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 N-CA-C 107.853 -1.165 . . . . 1.72 107.853 -176.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.447 ' H ' HG21 ' A' ' 58' ' ' VAL . 10.8 t -141.55 155.61 45.77 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 119.271 0.942 . . . . 2.39 108.819 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 49' ' ' ALA . 73.4 mt -135.35 125.76 16.94 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 109.054 -0.721 . . . . 1.21 109.054 -176.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.13 124.84 16.85 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.115 2.543 . . . . 1.09 112.09 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.567 1.321 . . . . 1.83 114.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.564 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 15.3 t70 -71.03 -34.77 71.62 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.007 -0.677 . . . . 2.34 110.664 -176.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.39 -35.17 56.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.603 -0.888 . . . . 1.24 108.603 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -24.7 63.62 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.173 -0.921 . . . . 1.13 110.938 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.4 1.67 55.99 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.093 -0.575 . . . . 0.61 112.463 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 34.6 mmt180 -97.16 -17.58 19.81 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 122.243 -0.563 . . . . 4.72 110.3 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.524 HG22 HD21 ' A' ' 45' ' ' LEU . 30.6 m -76.43 109.94 11.16 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-O 122.045 0.926 . . . . 1.15 109.749 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -93.4 -30.83 14.89 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-N 115.033 -0.985 . . . . 1.91 109.224 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 32.9 p -118.76 136.0 23.99 Favored Pre-proline 0 N--CA 1.402 -2.841 0 CA-C-N 114.315 -1.311 . . . . 1.16 110.15 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.828 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 85.5 Cg_exo -50.58 -30.74 29.19 Favored 'Trans proline' 0 CA--C 1.51 -0.703 0 C-N-CA 124.218 3.279 . . . . 0.36 114.084 -178.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -51.72 -44.86 63.38 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 123.313 0.383 . . . . 1.84 110.891 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -67.89 -45.47 74.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 124.403 1.081 . . . . 2.13 110.03 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.49 HD21 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -66.62 -44.15 82.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.829 -1.078 . . . . 1.56 109.864 -176.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.14 -52.64 64.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.309 -0.626 . . . . 1.12 109.309 177.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.27 -44.68 75.85 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.14 0.976 . . . . 0.57 111.706 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.47 -52.05 67.26 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 115.028 -0.987 . . . . 2.48 110.219 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 52.1 mt -69.4 -39.25 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.774 -0.648 . . . . 1.19 110.282 -178.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -55.98 -46.31 78.68 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.32 0.248 . . . . 1.14 111.122 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.02 -43.85 96.64 Favored Glycine 0 N--CA 1.445 -0.762 0 O-C-N 123.832 0.707 . . . . 0.53 111.545 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.78 -38.21 73.4 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 122.652 0.381 . . . . 1.22 111.565 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.437 HD13 ' HG ' ' A' ' 5' ' ' LEU . 68.5 mt -66.55 -35.14 79.51 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 122.452 0.301 . . . . 1.97 111.794 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.71 95.93 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.707 -0.679 . . . . 1.26 111.065 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.72 -45.86 12.91 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.423 0.527 . . . . 2.44 112.423 -178.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.93 69.35 10.77 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.726 0.774 . . . . 2.12 111.216 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.579 0 N-CA-C 107.692 -1.225 . . . . 3.84 107.692 -179.784 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 CA--C 1.501 -0.937 0 N-CA-C 107.987 -1.116 . . . . 6.86 107.987 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.21 121.18 29.31 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.817 -0.809 . . . . 4.54 108.817 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.598 HG21 ' HE1' ' A' ' 56' ' ' TYR . 5.6 m -93.75 106.77 18.72 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 105.983 -1.858 . . . . 3.27 105.983 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.1 tp -113.77 162.76 15.9 Favored 'General case' 0 N--CA 1.396 -3.134 0 CA-C-N 114.297 -1.319 . . . . 1.89 111.126 -168.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.618 HD22 HD21 ' A' ' 52' ' ' LEU . 68.9 mt -91.57 124.28 35.61 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 124.025 0.93 . . . . 1.38 111.317 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.4 p -97.52 -177.81 3.93 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.276 -1.379 . . . . 1.29 107.276 170.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.649 HG23 ' HA ' ' A' ' 29' ' ' ASP . 8.5 m -58.19 -41.72 84.57 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 109.209 -0.663 . . . . 1.31 109.209 174.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -65.44 -43.04 91.68 Favored 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 115.609 -0.723 . . . . 1.65 112.071 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.407 ' HB3' HD23 ' A' ' 5' ' ' LEU . 12.3 m-20 -64.91 -39.65 93.85 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.577 -0.527 . . . . 1.41 109.577 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.58 HD11 HD11 ' A' ' 74' ' ' LEU . 20.0 tp -65.4 -56.26 13.54 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 114.785 -1.098 . . . . 1.23 109.424 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -49.18 -47.97 45.5 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.693 1.197 . . . . 3.04 111.18 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -56.65 -46.16 81.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.853 -1.067 . . . . 4.47 111.154 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.67 77.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.466 -0.788 . . . . 1.19 111.736 -176.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.406 HD11 HG23 ' A' ' 48' ' ' THR . 4.0 mm? -63.74 -57.16 10.82 Favored 'General case' 0 C--O 1.246 0.895 0 N-CA-C 109.298 -0.63 . . . . 2.05 109.298 175.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -54.48 -50.34 58.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-N 114.916 -1.038 . . . . 1.33 111.317 -175.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -61.05 -30.07 70.11 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.268 0.47 . . . . 2.05 112.268 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.3 m -80.27 -42.78 22.49 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.041 0.448 . . . . 1.66 112.065 -177.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.579 ' HB2' ' HG2' ' A' ' 20' ' ' GLU . . . -74.5 -32.4 62.51 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.209 0.528 . . . . 1.58 110.401 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.68 25.45 42.11 Favored Glycine 0 CA--C 1.493 -1.307 0 N-CA-C 110.857 -0.897 . . . . 2.32 110.857 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.579 ' HG2' ' HB2' ' A' ' 18' ' ' ALA . 41.8 mm-40 -71.26 136.19 47.82 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.495 -0.853 . . . . 5.17 111.689 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.8 p -77.26 -71.65 0.4 Allowed 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.062 -1.459 . . . . 5.27 107.062 170.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.26 -64.14 1.04 Allowed 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.598 -0.728 . . . . 4.5 109.55 175.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.451 ' O ' ' HB ' ' A' ' 24' ' ' THR . . . 64.52 34.39 89.79 Favored Glycine 0 CA--C 1.474 -2.529 0 CA-C-N 115.777 -0.647 . . . . 3.06 114.652 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.451 ' HB ' ' O ' ' A' ' 23' ' ' GLY . 53.9 m 74.01 154.28 0.15 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 124.348 0.675 . . . . 3.17 109.702 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.76 96.95 2.62 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.541 -1.281 . . . . 3.23 107.541 174.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.0 tp -112.95 2.86 15.97 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.731 -0.668 . . . . 1.6 110.205 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 p -72.85 100.35 2.88 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.53 -0.759 . . . . 1.86 111.764 -179.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 146.87 -167.89 28.19 Favored Glycine 0 C--O 1.259 1.665 0 N-CA-C 109.124 -1.59 . . . . 1.11 109.124 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.649 ' HA ' HG23 ' A' ' 7' ' ' THR . 8.4 m-20 -89.17 98.48 11.79 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.73 -0.841 . . . . 2.07 108.73 176.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -94.34 18.94 10.21 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.373 -0.831 . . . . 0.51 111.436 -174.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.716 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 63.4 mt -53.7 -24.93 16.2 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.197 1.184 . . . . 1.12 114.197 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.18 -19.56 19.96 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.22 0.533 . . . . 2.04 110.812 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.8 mt -80.36 128.34 33.44 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.715 -0.675 . . . . 2.01 109.887 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.72 155.37 35.69 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.126 -0.488 . . . . 4.79 109.996 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.405 ' HA ' HG12 ' A' ' 38' ' ' ILE . 81.8 m-85 -67.1 -44.14 80.75 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 120.872 -0.331 . . . . 0.43 110.432 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.2 -24.64 64.97 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.6 0.714 . . . . 2.79 110.533 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.78 -30.73 40.76 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.462 -0.79 . . . . 0.88 110.057 -177.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.405 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.5 pt -98.33 13.11 4.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 112.126 0.417 . . . . 1.25 112.126 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.02 48.96 18.22 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 115.881 -0.599 . . . . 0.66 112.91 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -134.37 118.33 17.33 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.699 0.629 . . . . 1.67 112.699 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -91.04 161.52 15.09 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.073 -0.512 . . . . 1.06 109.888 172.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.496 ' O ' ' HG3' ' A' ' 46' ' ' MET . 56.0 p -54.98 -29.44 56.99 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.476 1.287 . . . . 1.52 114.476 -179.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.11 -50.82 64.58 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 117.991 0.36 . . . . 2.24 110.424 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.98 86.71 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.68 0.752 . . . . 1.13 109.637 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.664 ' O ' ' HB ' ' A' ' 48' ' ' THR . 29.8 tp -63.87 -40.63 97.0 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.706 -1.134 . . . . 1.15 110.989 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.5 mtm -64.58 -37.06 86.26 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 121.774 -0.579 . . . . 2.13 112.02 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.73 -28.58 68.54 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.103 0.954 . . . . 1.88 109.829 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.664 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 62.5 m -64.89 -53.84 40.18 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.57 -1.641 . . . . 1.18 106.57 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.489 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.49 -36.21 68.87 Favored 'General case' 0 C--O 1.205 -1.287 0 CA-C-N 114.341 -1.299 . . . . 1.02 110.041 174.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.77 -40.76 80.53 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 122.917 0.487 . . . . 1.12 112.032 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.1 mtp85 -64.79 -39.3 93.37 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.654 0.74 . . . . 3.59 109.159 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.618 HD21 HD22 ' A' ' 5' ' ' LEU . 64.4 mt -65.27 -44.67 87.28 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.429 -1.26 . . . . 1.61 109.413 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 42.8 mt-10 -55.97 -50.55 70.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.541 -0.754 . . . . 0.48 110.227 176.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.1 m -62.99 -49.55 74.26 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.659 -0.701 . . . . 1.75 112.025 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -63.68 -44.06 94.83 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.446 0.536 . . . . 3.52 112.446 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.598 ' HE1' HG21 ' A' ' 3' ' ' THR . 62.6 m-85 -94.65 -7.45 40.8 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.08 0.77 . . . . 1.35 113.08 -173.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 69.39 51.54 26.25 Favored Glycine 0 C--O 1.24 0.483 0 N-CA-C 111.298 -0.721 . . . . 0.93 111.298 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.0 p -141.3 176.86 4.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 N-CA-C 107.62 -1.252 . . . . 1.72 107.62 -176.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 17.7 t -139.06 132.23 29.78 Favored 'General case' 0 N--CA 1.424 -1.755 0 N-CA-C 108.433 -0.951 . . . . 2.39 108.433 174.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.442 HD11 ' HB1' ' A' ' 49' ' ' ALA . 67.0 mt -104.59 123.14 41.25 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.003 -0.999 . . . . 1.21 108.933 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.505 ' HB2' HG22 ' A' ' 64' ' ' VAL . 36.9 Cg_exo -58.79 118.28 5.14 Favored 'Trans proline' 0 C--O 1.25 1.11 0 C-N-CA 122.373 2.049 . . . . 1.09 110.413 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.92 -26.87 38.94 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.699 0.799 . . . . 1.83 112.759 -176.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.96 -28.92 65.95 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 116.114 -0.493 . . . . 2.34 110.749 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.505 HG22 ' HB2' ' A' ' 61' ' ' PRO . 67.2 t -76.99 -48.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 N-CA-C 108.509 -0.923 . . . . 1.24 108.509 177.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.66 -30.74 63.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.955 -1.02 . . . . 1.13 112.097 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -89.15 -5.19 73.41 Favored Glycine 0 N--CA 1.439 -1.127 0 C-N-CA 120.051 -1.071 . . . . 0.61 113.009 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -98.53 -14.99 19.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.97 0.73 . . . . 4.72 112.97 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.497 HG22 HD23 ' A' ' 74' ' ' LEU . 26.7 m -79.66 121.56 33.18 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 CA-C-O 121.09 0.472 . . . . 1.15 110.933 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -93.16 -39.08 11.23 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.629 0.728 . . . . 1.91 110.911 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.421 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 34.9 p -115.42 138.47 23.73 Favored Pre-proline 0 N--CA 1.413 -2.316 0 CA-C-N 115.369 -0.832 . . . . 1.16 110.739 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.716 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 74.1 Cg_exo -52.75 -29.73 43.56 Favored 'Trans proline' 0 CA--C 1.508 -0.787 0 C-N-CA 124.34 3.36 . . . . 0.36 113.729 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -51.36 -44.93 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 123.439 0.462 . . . . 1.84 110.581 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.408 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 31.8 mt-10 -66.82 -49.28 66.29 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 123.982 0.913 . . . . 2.13 109.786 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.58 HD11 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -64.71 -43.61 92.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.743 -1.117 . . . . 1.56 110.193 -175.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 43.9 tp -57.28 -56.96 15.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 123.667 0.604 . . . . 1.12 109.98 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.66 -45.03 93.25 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 112.888 0.699 . . . . 0.57 112.888 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 73' ' ' GLU . 87.0 mt -61.77 -37.66 85.14 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 112.115 0.413 . . . . 2.48 112.115 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 64.7 mt -80.72 -35.57 14.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 C-N-CA 120.23 -0.588 . . . . 1.19 109.977 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -57.74 -40.94 80.84 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 110.383 -0.228 . . . . 1.14 110.383 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.406 ' O ' ' HG2' ' A' ' 84' ' ' GLU . . . -61.61 -40.8 99.22 Favored Glycine 0 N--CA 1.45 -0.375 0 O-C-N 123.613 0.57 . . . . 0.53 112.033 176.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.27 -30.79 68.98 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.179 0.514 . . . . 1.22 110.458 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 86.6 mt -77.19 -34.19 56.26 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.719 -0.673 . . . . 1.97 110.444 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.0 74.8 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.237 0.542 . . . . 1.26 110.777 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 80' ' ' GLY . 11.9 pt-20 -94.84 14.82 20.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.77 -0.65 . . . . 2.44 111.038 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -93.67 161.3 14.4 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.188 -1.041 . . . . 2.12 108.188 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.707 0 N-CA-C 108.885 -0.783 . . . . 3.84 108.885 -176.574 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.431 ' H1 ' ' CG ' ' A' ' 9' ' ' ASP . 25.6 mmt . . . . . 0 CA--C 1.497 -1.092 0 N-CA-C 107.131 -1.433 . . . . 6.86 107.131 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.46 -23.38 27.85 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.235 -1.394 . . . . 4.54 107.235 173.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.2 m -119.77 106.42 12.09 Favored 'General case' 0 N--CA 1.417 -2.118 0 CA-C-N 114.1 -1.409 . . . . 3.27 107.217 176.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.3 mp 63.0 -175.46 0.15 Allowed 'General case' 0 C--O 1.25 1.081 0 N-CA-C 115.012 1.486 . . . . 1.89 115.012 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.475 HD13 HD21 ' A' ' 52' ' ' LEU . 82.3 mt -113.86 132.9 55.73 Favored 'General case' 0 CA--C 1.491 -1.319 0 CA-C-N 113.718 -1.583 . . . . 1.38 108.431 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.8 p -99.8 -174.78 2.79 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 108.909 -0.775 . . . . 1.29 108.909 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -57.75 -45.81 85.38 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.418 0.627 . . . . 1.31 109.31 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -61.18 -42.35 98.42 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 114.789 -1.096 . . . . 1.65 110.636 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.431 ' CG ' ' H1 ' ' A' ' 1' ' ' MET . 41.0 m-20 -66.83 -40.73 88.1 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 115.666 -0.697 . . . . 1.41 111.413 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.412 HD13 HD13 ' A' ' 74' ' ' LEU . 15.9 tp -63.85 -38.44 91.1 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.539 -0.755 . . . . 1.23 109.31 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.515 ' O ' HG23 ' A' ' 15' ' ' VAL . 39.8 ttm105 -56.12 -54.35 46.17 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.526 -0.761 . . . . 3.04 109.998 173.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 8.6 tpt180 -57.43 -34.68 69.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 115.645 -0.707 . . . . 4.47 111.379 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.96 75.46 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.289 0.368 . . . . 1.19 110.275 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.444 ' O ' ' OH ' ' A' ' 40' ' ' TYR . 10.6 mp -67.02 -24.28 66.0 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.116 0.413 . . . . 2.05 112.116 177.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 11' ' ' ARG . 97.2 t -68.46 -45.99 81.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.979 -0.749 . . . . 1.33 108.979 175.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 14.4 mm-40 -62.66 -44.95 94.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.698 -0.683 . . . . 2.05 112.829 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.559 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 3.9 p -71.48 -30.62 66.19 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 112.64 0.608 . . . . 1.66 112.64 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.93 -57.22 3.97 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.375 0.607 . . . . 1.58 109.787 177.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.61 -129.11 9.77 Favored Glycine 0 N--CA 1.422 -2.278 0 N-CA-C 110.712 -0.955 . . . . 2.32 110.712 -177.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -91.8 13.44 18.28 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 120.837 0.351 . . . . 5.17 111.459 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.4 p -88.66 27.53 1.28 Allowed 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.688 0.756 . . . . 5.27 112.224 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 68.1 -61.28 0.39 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.121 1.769 . . . . 4.5 113.554 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.57 21.47 59.99 Favored Glycine 0 C--N 1.318 -0.461 0 N-CA-C 109.814 -1.314 . . . . 3.06 109.814 -173.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.4 p 61.6 -169.57 0.17 Allowed 'General case' 0 C--O 1.244 0.79 0 C-N-CA 126.598 1.959 . . . . 3.17 111.593 -176.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -84.12 105.76 15.23 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.022 -1.103 . . . . 3.23 108.022 175.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.6 tp -117.28 18.82 14.36 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.367 -0.833 . . . . 1.6 110.802 -171.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.7 m -70.1 143.94 52.26 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.786 -0.643 . . . . 1.86 110.753 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.78 -156.33 34.53 Favored Glycine 0 N--CA 1.442 -0.958 0 N-CA-C 110.796 -0.922 . . . . 1.11 110.796 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.82 134.8 33.9 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.551 -0.907 . . . . 2.07 108.551 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.432 ' HB2' HD12 ' A' ' 33' ' ' LEU . 18.6 p90 -126.48 20.33 7.31 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.896 -0.593 . . . . 0.51 109.947 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.74 ' HB3' ' HB2' ' A' ' 72' ' ' ARG . 22.2 mt -53.85 -31.31 49.02 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.144 1.164 . . . . 1.12 114.144 -178.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -95.63 -6.63 39.71 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.94 0.4 . . . . 2.04 111.24 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.432 HD12 ' HB2' ' A' ' 30' ' ' PHE . 65.0 mt -82.18 109.96 16.95 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 106.796 -1.557 . . . . 2.01 106.796 176.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HD2' ' OD1' ' A' ' 69' ' ' ASP . 32.5 mtm105 -72.08 152.77 42.13 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.457 -0.571 . . . . 4.79 109.457 -173.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.63 -46.75 86.83 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.567 -0.531 . . . . 0.43 109.567 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -57.98 -23.28 53.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.814 0.446 . . . . 2.79 111.956 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -83.14 -28.74 29.19 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.165 0.507 . . . . 0.88 110.702 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.4 pt -97.24 13.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.303 0.573 . . . . 1.25 112.097 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.24 32.17 32.35 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.928 -0.653 . . . . 0.66 112.774 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.444 ' OH ' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-85 -115.97 105.48 12.7 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.169 0.509 . . . . 1.67 111.388 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -83.3 158.6 22.15 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.766 -1.198 . . . . 1.06 107.766 176.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.624 ' O ' ' HG3' ' A' ' 46' ' ' MET . 53.5 p -52.19 -31.08 30.0 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.377 0.88 . . . . 1.52 113.377 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.1 -51.32 64.57 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 120.982 0.42 . . . . 2.24 110.069 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.32 84.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.386 0.612 . . . . 1.13 109.886 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.473 HD23 HG21 ' A' ' 68' ' ' VAL . 52.9 tp -61.88 -45.44 93.75 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 1.15 110.717 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 42' ' ' SER . 54.0 mtt -62.81 -39.32 93.91 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 110.247 -0.279 . . . . 2.13 110.247 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -62.37 -37.64 86.48 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.768 0.795 . . . . 1.88 108.921 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.422 HG22 HD12 ' A' ' 14' ' ' LEU . 83.8 m -67.99 -57.63 5.85 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.502 -1.227 . . . . 1.18 108.082 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.476 ' HA ' HD13 ' A' ' 52' ' ' LEU . . . -57.06 -32.38 66.17 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 114.532 -1.213 . . . . 1.02 111.033 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.58 83.61 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.477 0.711 . . . . 1.12 111.721 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.559 ' NH2' ' HA ' ' A' ' 17' ' ' SER . 75.0 mtt180 -66.53 -39.9 88.85 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.84 -1.073 . . . . 3.59 109.064 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.476 HD13 ' HA ' ' A' ' 49' ' ' ALA . 90.3 mt -64.86 -40.56 95.35 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.143 -0.935 . . . . 1.61 110.029 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -56.3 -55.29 35.14 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.66 -0.7 . . . . 0.48 109.641 174.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.0 t -63.14 -44.38 95.69 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 115.096 -0.957 . . . . 1.75 111.731 -176.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.13 -49.6 71.51 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.817 0.673 . . . . 3.52 112.817 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -94.13 -6.72 44.29 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 114.35 1.241 . . . . 1.35 114.35 -172.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.64 52.88 6.89 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.779 -1.2 . . . . 0.93 111.301 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.538 ' HB ' HD11 ' A' ' 82' ' ' LEU . 12.0 p -138.95 176.9 5.53 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 106.352 -1.721 . . . . 1.72 106.352 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.479 ' H ' HG23 ' A' ' 58' ' ' VAL . 17.1 t -141.7 145.08 34.46 Favored 'General case' 0 N--CA 1.415 -2.198 0 N-CA-C 108.712 -0.847 . . . . 2.39 108.712 177.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.472 HD11 ' HB1' ' A' ' 49' ' ' ALA . 64.4 mt -131.97 111.37 14.5 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.451 -1.314 . . . . 1.21 107.451 -178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.457 ' HB2' HG22 ' A' ' 64' ' ' VAL . 37.5 Cg_exo -62.02 128.97 25.67 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.7 2.267 . . . . 1.09 111.039 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.425 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 9.4 p-10 -55.06 -30.06 58.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.393 1.077 . . . . 1.83 112.48 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -68.36 -35.76 78.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.334 -0.617 . . . . 2.34 109.334 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.457 HG22 ' HB2' ' A' ' 61' ' ' PRO . 25.3 t -76.88 -47.68 27.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 108.382 -0.97 . . . . 1.24 108.382 176.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.15 -29.32 63.52 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 123.516 0.727 . . . . 1.13 112.509 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.445 ' HA2' ' HB2' ' A' ' 42' ' ' SER . . . -85.55 -2.51 87.07 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.66 -0.781 . . . . 0.61 112.953 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -100.18 -24.62 14.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.639 0.219 . . . . 4.72 111.341 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.473 HG21 HD23 ' A' ' 45' ' ' LEU . 12.3 m -73.61 120.4 22.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.975 0.893 . . . . 1.15 111.728 -175.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 28.4 t70 -91.59 -47.48 7.38 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-N 114.233 -1.349 . . . . 1.91 112.386 -175.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 41.1 p -107.85 143.18 26.79 Favored Pre-proline 0 N--CA 1.408 -2.56 0 CA-C-N 116.014 -0.539 . . . . 1.16 110.91 -177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.607 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 79.5 Cg_exo -53.74 -31.24 60.22 Favored 'Trans proline' 0 C--O 1.211 -0.839 0 C-N-CA 123.655 2.903 . . . . 0.36 111.706 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.74 ' HB2' ' HB3' ' A' ' 31' ' ' LEU . 25.0 ttp85 -51.4 -53.33 37.75 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 123.761 0.663 . . . . 1.84 111.03 174.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.84 -39.78 87.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.25 -0.432 . . . . 2.13 111.049 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.425 HD22 HG23 ' A' ' 68' ' ' VAL . 3.1 tm? -68.16 -44.85 75.05 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.406 -0.361 . . . . 1.56 111.207 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.2 tp -56.99 -50.06 73.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.22 -0.659 . . . . 1.12 109.22 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.54 -37.71 88.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.179 -0.918 . . . . 0.57 111.635 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.437 HD12 HG12 ' A' ' 64' ' ' VAL . 5.1 tt -58.3 -52.35 65.97 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 108.835 -0.802 . . . . 2.48 108.835 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.5 mt -64.56 -50.7 74.71 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 N-CA-C 109.131 -0.692 . . . . 1.19 109.131 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -51.2 -44.05 61.5 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.547 0.53 . . . . 1.14 111.871 -178.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.55 -48.73 48.79 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 121.237 -0.506 . . . . 0.53 112.456 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.92 79.41 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.122 0.487 . . . . 1.22 111.276 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.538 HD11 ' HB ' ' A' ' 58' ' ' VAL . 17.5 tp -70.95 -33.32 70.37 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.707 -0.679 . . . . 1.97 110.248 -177.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.95 68.86 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.899 0.38 . . . . 1.26 111.212 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -77.48 -21.32 52.99 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.867 -0.606 . . . . 2.44 111.541 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.78 136.64 38.15 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.205 -0.452 . . . . 2.12 109.881 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.469 0 N-CA-C 108.335 -0.987 . . . . 3.84 108.335 178.561 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.416 ' HA ' ' OXT' ' A' ' 86' ' ' ALA . 56.2 ttp . . . . . 0 CA--C 1.509 -0.631 0 N-CA-C 108.333 -0.988 . . . . 6.86 108.333 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.9 108.74 1.26 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.026 -0.731 . . . . 4.54 109.026 175.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.5 t -71.88 126.29 29.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.288 1.042 . . . . 3.27 110.077 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.4 tp -68.68 154.42 41.96 Favored 'General case' 0 N--CA 1.409 -2.519 0 CA-C-N 113.827 -1.533 . . . . 1.89 109.564 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.37 124.58 48.19 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.318 -0.623 . . . . 1.38 109.318 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.7 p -104.26 -170.82 1.82 Allowed 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.727 -1.212 . . . . 1.29 107.727 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.794 HG22 ' HA ' ' A' ' 29' ' ' ASP . 27.9 m -56.07 -49.55 73.48 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.152 0.501 . . . . 1.31 110.035 177.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.32 -43.3 88.12 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 114.89 -1.05 . . . . 1.65 110.267 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.13 -43.2 78.87 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.594 -0.73 . . . . 1.41 110.814 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.57 HD11 HD12 ' A' ' 74' ' ' LEU . 14.3 tp -65.19 -38.16 89.59 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.121 -0.945 . . . . 1.23 109.946 -175.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.78 ' HG3' ' HB3' ' A' ' 26' ' ' LEU . 36.8 ttp180 -51.01 -52.65 40.8 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.203 -0.908 . . . . 3.04 110.39 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.62 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 79.0 ttt180 -57.69 -42.77 84.34 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.021 -0.536 . . . . 4.47 111.982 -177.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.21 84.66 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.151 0.282 . . . . 1.19 110.663 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.586 HD22 HG22 ' A' ' 48' ' ' THR . 97.2 mt -65.85 -41.73 91.35 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.941 -0.572 . . . . 2.05 110.17 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 11' ' ' ARG . 57.3 t -61.59 -49.97 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.198 0.599 . . . . 1.33 110.111 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 48.1 mm-40 -57.35 -45.43 84.35 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.728 -0.669 . . . . 2.05 109.845 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.506 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.8 m -74.97 -19.47 60.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.456 -0.793 . . . . 1.66 112.547 -175.615 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.79 -13.37 42.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.514 0.673 . . . . 1.58 109.589 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.91 -69.98 2.36 Favored Glycine 0 CA--C 1.494 -1.22 0 N-CA-C 110.293 -1.123 . . . . 2.32 110.293 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -136.11 118.21 15.42 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 105.558 -2.016 . . . . 5.17 105.558 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.505 HG23 ' H ' ' A' ' 23' ' ' GLY . 11.2 m -113.8 133.07 55.62 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.946 -0.39 . . . . 5.27 109.946 -173.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.19 -23.56 65.77 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.793 0.806 . . . . 4.5 109.713 176.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.505 ' H ' HG23 ' A' ' 21' ' ' THR . . . 124.29 -44.25 1.3 Allowed Glycine 0 N--CA 1.424 -2.148 0 CA-C-N 114.858 -1.064 . . . . 3.06 110.711 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.53 ' HG1' HD12 ' A' ' 26' ' ' LEU . 60.1 p 51.54 35.17 13.86 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.736 1.215 . . . . 3.17 112.705 178.251 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.7 t70 57.34 36.94 27.81 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.281 1.432 . . . . 3.23 111.832 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.78 ' HB3' ' HG3' ' A' ' 11' ' ' ARG . 6.6 mp -82.76 -8.87 59.56 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.7 -0.682 . . . . 1.6 111.207 175.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 127.64 33.57 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.714 -0.675 . . . . 1.86 109.471 177.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.57 -129.48 9.92 Favored Glycine 0 N--CA 1.432 -1.579 0 N-CA-C 111.39 -0.684 . . . . 1.11 111.39 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.794 ' HA ' HG22 ' A' ' 7' ' ' THR . 29.0 t70 -121.6 116.38 24.51 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 108.898 -0.778 . . . . 2.07 108.898 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -121.86 22.2 10.47 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.96 -0.564 . . . . 0.51 111.142 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.47 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 55.6 mt -52.55 -19.47 2.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.417 1.636 . . . . 1.12 115.417 -177.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -92.97 -19.7 21.35 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.403 0.144 . . . . 2.04 111.345 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.23 122.22 26.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 2.01 110.281 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.513 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 34.6 mtm105 -77.8 145.85 36.14 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.962 -0.563 . . . . 4.79 109.798 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.586 ' HA ' HG12 ' A' ' 38' ' ' ILE . 46.6 m-85 -61.97 -42.08 98.73 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.582 -0.281 . . . . 0.43 110.795 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.94 -38.59 70.53 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.381 0.61 . . . . 2.79 110.24 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.11 -22.55 42.02 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.43 -0.805 . . . . 0.88 111.069 -173.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.586 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.6 pt -92.3 13.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.751 0.786 . . . . 1.25 110.55 177.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.91 87.5 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.571 -0.74 . . . . 0.66 113.81 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -81.83 131.86 35.27 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 112.189 0.441 . . . . 1.67 112.189 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.14 142.46 30.34 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.216 -1.772 . . . . 1.06 106.216 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 46' ' ' MET . 33.7 p -54.12 -31.98 53.76 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.522 0.934 . . . . 1.52 113.522 179.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.2 tp -64.68 -42.1 95.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.89 0.376 . . . . 2.24 110.234 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.62 -36.37 84.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.506 0.669 . . . . 1.13 109.709 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.496 HD21 HG22 ' A' ' 68' ' ' VAL . 54.7 tp -63.92 -45.23 90.2 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.205 -0.907 . . . . 1.15 109.931 176.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 42' ' ' SER . 83.3 mtp -61.89 -38.28 87.75 Favored 'General case' 0 C--O 1.196 -1.714 0 CA-C-N 115.931 -0.577 . . . . 2.13 110.258 176.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.463 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.8 tp10 -60.96 -35.2 76.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.806 0.842 . . . . 1.88 109.871 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.586 HG22 HD22 ' A' ' 14' ' ' LEU . 87.3 m -66.61 -57.33 7.44 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.566 -1.272 . . . . 1.18 107.566 -178.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.516 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.12 -43.61 74.26 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 113.725 -1.58 . . . . 1.02 109.567 177.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.07 91.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.75 0.82 . . . . 1.12 113.038 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 84.1 mtt180 -66.47 -38.27 86.96 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.23 -0.441 . . . . 3.59 109.989 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.62 -38.05 89.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.872 -0.604 . . . . 1.61 109.926 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -57.29 -55.12 38.83 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.642 -0.503 . . . . 0.48 109.642 173.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 59.2 p -61.19 -38.06 85.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.679 0.612 . . . . 1.75 112.504 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -71.01 -46.27 62.48 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.63 0.974 . . . . 3.52 113.63 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -101.74 -13.97 17.53 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 114.697 1.369 . . . . 1.35 114.697 -172.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.5 40.32 Favored Glycine 0 C--N 1.308 -0.986 0 C-N-CA 120.099 -1.048 . . . . 0.93 110.885 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.453 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 4.1 p -97.09 135.31 31.68 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 N-CA-C 109.126 -0.694 . . . . 1.72 109.126 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 m -96.77 106.07 18.3 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 109.92 -0.4 . . . . 2.39 109.92 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.9 mt -102.19 117.45 61.25 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 110.362 -0.236 . . . . 1.21 110.362 -179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.78 131.21 26.78 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.222 1.948 . . . . 1.09 110.329 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -51.88 -34.1 39.62 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.634 0.976 . . . . 1.83 113.634 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.615 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 3.4 m-20 -66.44 -45.62 79.22 Favored 'General case' 0 CA--C 1.495 -1.15 0 CA-C-O 120.566 0.222 . . . . 2.34 110.777 -178.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.5 t -71.27 -31.68 44.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.538 -0.542 . . . . 1.24 109.538 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.82 -22.51 58.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.911 -0.586 . . . . 1.13 112.228 177.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.61 0.84 27.65 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 120.553 -0.832 . . . . 0.61 111.923 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.615 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 4.6 mmp_? -96.41 -15.11 21.98 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.185 -0.672 . . . . 4.72 109.185 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.507 HG21 HD23 ' A' ' 74' ' ' LEU . 19.5 m -76.85 91.84 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 CA-C-O 122.559 1.171 . . . . 1.15 109.641 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.513 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 18.9 t70 -86.23 -35.57 19.94 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 114.417 -1.265 . . . . 1.91 111.375 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.404 HG23 ' HG2' ' A' ' 34' ' ' ARG . 45.0 p -113.75 149.17 41.33 Favored Pre-proline 0 C--N 1.284 -2.255 0 N-CA-C 109.355 -0.609 . . . . 1.16 109.355 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.47 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.6 Cg_exo -52.27 -39.99 71.01 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.561 2.841 . . . . 0.36 112.949 -178.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.9 ptp85 -50.86 -40.94 57.42 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 123.715 0.634 . . . . 1.84 112.52 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.01 -52.6 58.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.059 0.457 . . . . 2.13 110.802 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.57 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -67.86 -42.05 81.94 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.083 -0.962 . . . . 1.56 109.99 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.9 tp -56.41 -57.02 14.08 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.524 -0.762 . . . . 1.12 109.321 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.73 -39.2 80.17 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.926 -0.579 . . . . 0.57 112.253 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.04 -46.45 89.49 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.214 0.53 . . . . 2.48 109.633 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.44 -36.73 20.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-N 116.069 -0.514 . . . . 1.19 110.292 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -56.96 -47.03 81.69 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.223 0.209 . . . . 1.14 110.95 177.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.53 -39.68 97.67 Favored Glycine 0 N--CA 1.447 -0.592 0 O-C-N 123.552 0.533 . . . . 0.53 112.155 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.37 75.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.023 0.44 . . . . 1.22 110.518 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.9 mt -68.24 -33.97 75.36 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.97 -0.559 . . . . 1.97 110.691 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.66 -27.34 69.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.428 0.691 . . . . 1.26 111.917 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -84.33 -5.9 59.32 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.519 -0.473 . . . . 2.44 111.4 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -115.06 176.25 5.14 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 108.654 -0.869 . . . . 2.12 108.654 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.416 ' OXT' ' HA ' ' A' ' 1' ' ' MET . . . . . . . . 0 C--N 1.29 -2.009 0 N-CA-C 107.38 -1.341 . . . . 3.84 107.38 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tpt . . . . . 0 CA--C 1.516 -0.333 0 N-CA-C 109.693 -0.484 . . . . 6.86 109.693 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -144.0 136.53 26.92 Favored 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 108.389 -0.967 . . . . 4.54 108.389 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -72.92 106.51 4.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.569 0.699 . . . . 3.27 110.164 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 72.71 173.77 0.3 Allowed 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 113.81 -1.541 . . . . 1.89 112.641 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.481 HD23 ' OD1' ' A' ' 9' ' ' ASP . 88.3 mt -126.52 147.45 49.84 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 108.672 -0.862 . . . . 1.38 108.672 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.8 p -99.43 172.78 7.11 Favored 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 107.372 -1.344 . . . . 1.29 107.372 174.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.693 HG21 ' HA ' ' A' ' 29' ' ' ASP . 21.0 m -58.9 -31.25 68.44 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.278 -0.638 . . . . 1.31 109.278 172.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -66.02 -50.68 63.37 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.356 -0.838 . . . . 1.65 111.716 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.481 ' OD1' HD23 ' A' ' 5' ' ' LEU . 15.4 t70 -68.44 -37.8 80.57 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.347 -0.541 . . . . 1.41 109.909 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.507 HD22 ' HB2' ' A' ' 75' ' ' LEU . 18.4 tp -62.67 -42.95 99.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.28 -0.873 . . . . 1.23 108.984 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.517 ' O ' HG21 ' A' ' 15' ' ' VAL . 42.2 ttp180 -50.35 -38.19 40.83 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 124.507 1.123 . . . . 3.04 111.12 178.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.668 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 59.6 ttt180 -56.25 -51.39 68.28 Favored 'General case' 0 C--O 1.216 -0.665 0 O-C-N 123.592 0.557 . . . . 4.47 110.724 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.45 -37.17 84.85 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 123.379 0.424 . . . . 1.19 111.909 -174.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.489 HD11 HG23 ' A' ' 48' ' ' THR . 3.8 mm? -66.84 -29.66 69.64 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.312 -0.404 . . . . 2.05 111.296 176.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.517 HG21 ' O ' ' A' ' 11' ' ' ARG . 61.8 t -77.67 -39.97 27.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.401 -0.592 . . . . 1.33 109.401 176.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.668 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 6.7 mm-40 -55.99 -53.18 60.01 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.015 0.926 . . . . 2.05 110.655 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -77.03 -18.45 58.11 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.552 -0.749 . . . . 1.66 111.866 -174.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.88 -51.66 6.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.004 0.43 . . . . 1.58 109.999 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.36 -89.27 0.51 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.87 -1.292 . . . . 2.32 109.87 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -125.44 99.43 6.03 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 122.036 0.922 . . . . 5.17 110.852 177.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.3 m -133.66 -89.4 0.39 Allowed 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 104.81 -2.293 . . . . 5.27 104.81 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -171.62 132.51 0.75 Allowed 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 124.247 1.019 . . . . 4.5 108.288 170.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.69 78.89 1.29 Allowed Glycine 0 CA--C 1.455 -3.709 0 N-CA-C 108.634 -1.787 . . . . 3.06 108.634 175.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 m -69.36 73.78 0.34 Allowed 'General case' 0 N--CA 1.412 -2.374 0 CA-C-N 113.54 -1.33 . . . . 3.17 111.941 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.1 t70 61.57 39.01 15.14 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.435 1.494 . . . . 3.23 110.92 178.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.3 mp -77.85 -16.52 58.24 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.376 -0.829 . . . . 1.6 110.868 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -59.96 133.7 56.34 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.45 -0.795 . . . . 1.86 109.77 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.3 -106.87 3.21 Favored Glycine 0 N--CA 1.429 -1.791 0 N-CA-C 111.045 -0.822 . . . . 1.11 111.045 -176.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.693 ' HA ' HG21 ' A' ' 7' ' ' THR . 12.0 t70 -129.85 137.46 50.46 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.049 -1.093 . . . . 2.07 108.049 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.415 ' CZ ' ' HG ' ' A' ' 14' ' ' LEU . 11.8 p90 -137.66 20.13 2.89 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.793 -0.363 . . . . 0.51 110.177 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.73 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 75.7 mt -54.98 -22.42 15.19 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.15 0.796 . . . . 1.12 113.15 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -92.12 -14.59 28.94 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.733 0.813 . . . . 2.04 111.0 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -80.11 131.77 35.81 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 115.891 -0.595 . . . . 2.01 109.978 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.628 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 14.3 mmt180 -76.65 137.56 39.51 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.371 -0.603 . . . . 4.79 109.371 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 40' ' ' TYR . 47.2 m-85 -62.76 -37.72 87.74 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 107.638 -1.245 . . . . 0.43 107.638 175.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -55.45 -33.92 64.03 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.418 -1.265 . . . . 2.79 110.332 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.3 -35.08 28.34 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 115.983 -0.553 . . . . 0.88 110.617 -176.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.498 HG12 ' HA ' ' A' ' 35' ' ' PHE . 38.0 pt -90.44 16.14 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.404 -0.518 . . . . 1.25 111.042 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 28.74 73.91 Favored Glycine 0 C--O 1.238 0.39 0 CA-C-N 115.341 -0.845 . . . . 0.66 113.236 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.631 ' HB3' ' HB3' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -97.37 114.03 25.78 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 109.469 -0.567 . . . . 1.67 109.469 -177.694 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.11 149.98 25.17 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 116.053 -0.521 . . . . 1.06 110.547 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 77.6 p -50.74 -33.94 25.09 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.916 1.08 . . . . 1.52 113.916 179.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.31 -49.42 69.55 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.841 -0.8 . . . . 2.24 108.841 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.07 -37.91 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.723 -0.671 . . . . 1.13 109.838 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.626 HD22 HG22 ' A' ' 68' ' ' VAL . 63.5 tp -62.95 -46.39 87.97 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.393 -0.821 . . . . 1.15 110.994 177.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 67.6 mtt -63.05 -36.56 83.99 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 110.168 -0.308 . . . . 2.13 110.168 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 37.9 tt0 -64.55 -31.26 72.4 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.501 0.667 . . . . 1.88 110.831 176.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.518 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 96.8 m -66.06 -55.49 16.29 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.462 -1.31 . . . . 1.18 107.462 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.46 ' HB3' HD11 ' A' ' 60' ' ' ILE . . . -56.71 -38.63 72.59 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 113.909 -1.496 . . . . 1.02 109.795 175.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.8 78.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.486 0.714 . . . . 1.12 111.63 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 71.3 mtt180 -63.67 -39.38 94.2 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.365 -0.834 . . . . 3.59 109.933 179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 59.2 mt -65.36 -41.96 93.27 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.068 0.396 . . . . 1.61 112.068 176.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.8 mt-10 -57.59 -48.62 78.9 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 122.325 0.25 . . . . 0.48 110.544 175.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -63.43 -44.51 94.36 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.389 0.614 . . . . 1.75 111.428 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -65.99 -44.12 85.78 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.154 -0.93 . . . . 3.52 112.844 -176.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -101.57 -18.59 15.85 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 115.296 1.591 . . . . 1.35 115.296 -177.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.84 62.37 1.77 Allowed Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.257 -0.973 . . . . 0.93 111.434 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.1 m -139.21 177.77 4.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 C-N-CA 123.523 0.729 . . . . 1.72 110.125 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -140.22 115.95 10.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 123.632 0.583 . . . . 2.39 109.855 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.46 HD11 ' HB3' ' A' ' 49' ' ' ALA . 86.4 mt -101.01 130.31 25.34 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.461 -0.79 . . . . 1.21 110.294 -177.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.93 126.75 22.02 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.781 2.321 . . . . 1.09 111.647 176.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -51.35 -54.01 30.64 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.854 1.262 . . . . 1.83 113.658 -173.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.11 -28.45 63.29 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 116.235 -0.439 . . . . 2.34 111.66 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.79 -37.62 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.462 -0.94 . . . . 1.24 108.462 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.93 -24.99 60.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.105 -0.952 . . . . 1.13 111.377 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.56 11.98 39.16 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 121.057 -0.592 . . . . 0.61 112.618 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -105.23 -21.62 13.22 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.378 0.608 . . . . 4.72 110.535 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.626 HG22 HD22 ' A' ' 45' ' ' LEU . 28.6 m -76.64 115.67 18.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 121.597 0.713 . . . . 1.15 111.286 -176.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.628 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 33.3 t70 -97.79 -23.76 15.75 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 121.62 0.724 . . . . 1.91 110.533 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 70.7 p -116.75 143.97 32.45 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.512 -0.767 . . . . 1.16 110.897 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.73 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 39.4 Cg_exo -59.36 -30.82 93.74 Favored 'Trans proline' 0 C--O 1.204 -1.204 0 C-N-CA 123.308 2.672 . . . . 0.36 112.352 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.539 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 6.0 ptp180 -54.75 -44.78 73.91 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.12 -0.232 . . . . 1.84 111.329 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.2 -46.19 81.71 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.197 0.522 . . . . 2.13 109.829 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.454 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.1 -45.13 82.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.263 -0.881 . . . . 1.56 110.553 -176.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.507 ' HB2' HD22 ' A' ' 10' ' ' LEU . 61.8 tp -57.2 -54.19 49.59 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 109.454 -0.573 . . . . 1.12 109.454 176.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -59.99 -37.73 80.54 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 123.908 0.755 . . . . 0.57 111.804 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.92 -50.1 74.78 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 122.925 0.49 . . . . 2.48 110.522 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.8 mt -70.41 -31.13 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.566 -0.531 . . . . 1.19 109.566 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -39.61 93.62 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-N 116.067 -0.515 . . . . 1.14 109.647 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.58 -38.9 93.7 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.857 -0.497 . . . . 0.53 111.857 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.84 -37.89 79.44 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.23 0.538 . . . . 1.22 110.194 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.7 mt -74.93 -20.92 59.49 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.908 -0.587 . . . . 1.97 111.117 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.02 -27.15 67.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.027 0.441 . . . . 1.26 110.536 174.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -85.78 -22.39 27.71 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.434 0.635 . . . . 2.44 110.396 177.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.99 162.26 14.46 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.53 -0.759 . . . . 2.12 109.568 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.291 -1.961 0 N-CA-C 107.503 -1.295 . . . . 3.84 107.503 178.955 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 C--O 1.237 0.431 0 N-CA-C 110.071 -0.344 . . . . 6.86 110.071 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.28 114.13 14.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 121.295 0.569 . . . . 4.54 110.834 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 15.1 t -147.23 131.16 17.14 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 106.29 -1.744 . . . . 3.27 106.29 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.7 tp -68.46 149.46 49.27 Favored 'General case' 0 N--CA 1.411 -2.391 0 CA-C-N 115.083 -0.962 . . . . 1.89 111.398 -172.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.6 ' HG ' HD13 ' A' ' 82' ' ' LEU . 79.8 mt -98.5 129.07 45.08 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 115.091 -0.959 . . . . 1.38 108.42 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -96.6 -171.97 2.39 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 107.144 -1.428 . . . . 1.29 107.144 173.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 m -56.73 -38.91 73.03 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.265 0.555 . . . . 1.31 110.218 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.79 -41.1 60.63 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 111.367 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.94 -36.03 83.07 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.896 -0.779 . . . . 1.41 108.896 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.465 HD11 ' CD1' ' A' ' 74' ' ' LEU . 19.7 tp -66.21 -50.88 62.32 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.829 -1.078 . . . . 1.23 108.474 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.409 ' O ' HG21 ' A' ' 15' ' ' VAL . 11.9 ttp180 -50.33 -42.13 52.38 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.82 0.7 . . . . 3.04 111.509 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -53.21 -47.04 69.25 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.727 0.642 . . . . 4.47 110.325 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' HB1' HD21 ' A' ' 52' ' ' LEU . . . -66.06 -42.83 88.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.696 -0.684 . . . . 1.19 112.085 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.612 HD11 HG22 ' A' ' 48' ' ' THR . 4.1 mm? -64.08 -34.79 78.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.008 0.433 . . . . 2.05 111.157 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 11' ' ' ARG . 95.1 t -69.55 -25.03 27.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 120.997 0.427 . . . . 1.33 111.499 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.44 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 5.6 mm-40 -63.35 -45.96 88.76 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.174 0.511 . . . . 2.05 111.822 177.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 p -83.03 -20.97 34.01 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.443 0.64 . . . . 1.66 110.919 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.537 ' HB2' ' OH ' ' A' ' 40' ' ' TYR . . . -74.5 -18.57 60.59 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.689 -0.687 . . . . 1.58 111.437 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.405 ' C ' ' H ' ' A' ' 21' ' ' THR . . . 69.55 -95.19 0.44 Allowed Glycine 0 C--O 1.222 -0.596 0 N-CA-C 111.125 -0.79 . . . . 2.32 111.125 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.97 25.88 0.65 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.448 0.642 . . . . 5.17 110.463 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.532 HG22 ' HA ' ' A' ' 25' ' ' ASP . 6.2 m 62.06 38.99 13.6 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.37 1.068 . . . . 5.27 109.792 -176.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -61.23 146.33 48.16 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 114.844 -1.071 . . . . 4.5 109.088 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.74 22.49 5.36 Favored Glycine 0 N--CA 1.416 -2.698 0 N-CA-C 109.417 -1.473 . . . . 3.06 109.417 -173.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.1 p 66.96 19.89 10.54 Favored 'General case' 0 C--O 1.247 0.947 0 C-N-CA 126.203 1.801 . . . . 3.17 112.722 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.532 ' HA ' HG22 ' A' ' 21' ' ' THR . 14.9 t70 61.29 130.38 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.379 1.071 . . . . 3.23 111.39 -172.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -110.97 24.91 12.35 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.784 -0.572 . . . . 1.6 111.813 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 t -61.29 113.51 2.66 Favored 'General case' 0 C--O 1.251 1.18 0 CA-C-O 121.037 0.446 . . . . 1.86 110.587 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.72 -140.89 15.59 Favored Glycine 0 N--CA 1.429 -1.795 0 N-CA-C 110.802 -0.919 . . . . 1.11 110.802 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -102.49 124.78 48.67 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.939 -0.763 . . . . 2.07 108.939 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -133.52 14.73 4.08 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.104 -0.638 . . . . 0.51 111.17 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 42.4 mt -52.86 -31.96 42.21 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 114.071 1.137 . . . . 1.12 114.071 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -94.29 -7.42 41.98 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 116.276 -0.42 . . . . 2.04 111.86 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mp -84.84 123.58 30.62 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.741 -1.207 . . . . 2.01 107.741 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -73.95 145.65 44.53 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 109.71 -0.478 . . . . 4.79 109.71 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.515 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 51.9 m-85 -61.49 -36.42 80.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.368 -0.605 . . . . 0.43 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -56.28 -36.78 68.99 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.318 -0.856 . . . . 2.79 110.726 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.9 -35.43 37.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.837 -0.62 . . . . 0.88 110.141 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -93.27 12.91 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 113.267 0.84 . . . . 1.25 113.267 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.49 41.11 30.91 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.051 -0.595 . . . . 0.66 114.27 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.537 ' OH ' ' HB2' ' A' ' 18' ' ' ALA . 13.7 m-85 -116.95 110.23 18.03 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 122.625 0.37 . . . . 1.67 110.724 176.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -88.46 155.09 19.86 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 120.562 -0.455 . . . . 1.06 110.313 174.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 46' ' ' MET . 79.4 p -51.94 -33.42 37.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.315 1.228 . . . . 1.52 114.315 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.26 -51.78 58.61 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.886 -0.413 . . . . 2.24 109.886 -178.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.49 89.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.498 0.666 . . . . 1.13 110.058 175.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.517 ' O ' ' HB ' ' A' ' 48' ' ' THR . 60.0 tp -62.37 -47.55 83.66 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.138 -0.937 . . . . 1.15 110.945 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.418 ' HG3' ' O ' ' A' ' 42' ' ' SER . 62.1 mtm -63.87 -37.23 86.61 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 122.443 -0.161 . . . . 2.13 110.796 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.627 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 40.2 tt0 -62.2 -31.43 71.95 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.49 0.662 . . . . 1.88 109.912 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.612 HG22 HD11 ' A' ' 14' ' ' LEU . 65.2 m -66.67 -56.9 8.49 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.591 -1.263 . . . . 1.18 107.591 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 60' ' ' ILE . . . -57.34 -35.48 69.95 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 114.384 -1.28 . . . . 1.02 110.553 176.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.47 -44.05 84.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.411 0.684 . . . . 1.12 111.933 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.627 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 44.2 mtt180 -64.78 -37.12 86.54 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.303 -0.862 . . . . 3.59 109.412 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.539 HD21 ' HB1' ' A' ' 13' ' ' ALA . 98.2 mt -67.62 -45.86 74.21 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.21 -0.905 . . . . 1.61 111.286 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.2 mt-10 -54.43 -51.99 63.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 123.093 0.557 . . . . 0.48 110.214 178.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 m -61.91 -48.85 78.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 114.943 -1.026 . . . . 1.75 111.829 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 55' ' ' ARG . 12.0 ttm180 -65.6 -48.65 71.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.392 0.515 . . . . 3.52 112.392 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -91.86 2.57 56.44 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.215 0.82 . . . . 1.35 113.215 -171.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.71 56.5 18.74 Favored Glycine 0 C--O 1.25 1.102 0 CA-C-N 116.163 -0.471 . . . . 0.93 112.265 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.451 HG22 ' H ' ' A' ' 59' ' ' SER . 8.7 p -138.68 176.25 6.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 N-CA-C 107.962 -1.125 . . . . 1.72 107.962 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.451 ' H ' HG22 ' A' ' 58' ' ' VAL . 68.8 m -141.17 138.89 33.72 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 109.606 -0.516 . . . . 2.39 109.606 178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.477 HD11 ' HB2' ' A' ' 49' ' ' ALA . 65.6 mt -130.62 120.99 18.96 Favored Pre-proline 0 C--N 1.308 -1.223 0 N-CA-C 108.638 -0.875 . . . . 1.21 108.638 -177.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.402 ' HB2' HG23 ' A' ' 64' ' ' VAL . 38.1 Cg_exo -62.2 124.72 14.88 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.581 2.187 . . . . 1.09 110.175 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -51.66 -31.53 25.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.713 1.205 . . . . 1.83 112.946 -177.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -69.02 -38.41 79.2 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.934 0.397 . . . . 2.34 110.546 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.402 HG23 ' HB2' ' A' ' 61' ' ' PRO . 21.3 t -75.59 -41.8 41.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.0 -1.111 . . . . 1.24 108.0 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -28.16 66.62 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 115.639 -0.71 . . . . 1.13 111.689 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.42 10.77 59.68 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 121.005 -0.617 . . . . 0.61 112.036 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -101.3 -24.39 14.23 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.837 -0.801 . . . . 4.72 108.837 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.533 HG21 HD21 ' A' ' 74' ' ' LEU . 30.3 m -79.14 97.55 2.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-O 122.245 1.022 . . . . 1.15 110.775 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -88.02 -21.01 25.03 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.273 -0.876 . . . . 1.91 111.221 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 p -121.39 142.87 36.31 Favored Pre-proline 0 N--CA 1.413 -2.319 0 CA-C-N 115.998 -0.546 . . . . 1.16 109.572 179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.779 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.7 Cg_exo -53.24 -34.9 71.8 Favored 'Trans proline' 0 CA--C 1.514 -0.478 0 C-N-CA 123.616 2.877 . . . . 0.36 113.34 -178.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -52.79 -44.22 66.43 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 123.475 0.485 . . . . 1.84 110.878 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.404 ' HB3' HG12 ' A' ' 68' ' ' VAL . 60.9 mm-40 -65.46 -47.96 74.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.262 0.625 . . . . 2.13 110.516 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.533 HD21 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -66.99 -42.93 84.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.323 -0.853 . . . . 1.56 110.333 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 51.1 tp -58.33 -50.2 74.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.636 -0.505 . . . . 1.12 109.636 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.42 -41.77 90.3 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.545 0.738 . . . . 0.57 111.094 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.97 -57.18 14.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.029 0.932 . . . . 2.48 108.738 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.3 mt -68.64 -31.85 52.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.51 0 CA-C-N 115.699 -0.682 . . . . 1.19 111.425 -176.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.77 -44.32 93.93 Favored 'General case' 0 N--CA 1.481 1.114 0 O-C-N 122.187 -0.32 . . . . 1.14 110.505 175.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.72 -39.58 90.21 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.378 -0.689 . . . . 0.53 111.378 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.62 -35.33 75.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.64 0.376 . . . . 1.22 111.455 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.6 HD13 ' HG ' ' A' ' 5' ' ' LEU . 55.6 mt -68.67 -31.96 71.46 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 122.927 0.491 . . . . 1.97 111.861 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.75 -19.13 64.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.217 0.532 . . . . 1.26 111.294 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -129.07 29.27 5.2 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.115 -0.493 . . . . 2.44 109.965 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.413 ' HB2' ' HA ' ' A' ' 82' ' ' LEU . . . -78.72 105.95 10.37 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.115 0.483 . . . . 2.12 110.025 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.754 0 N-CA-C 108.271 -1.011 . . . . 3.84 108.271 -179.477 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.9 mmm . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 110.31 -0.256 . . . . 6.86 110.31 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.444 ' HB3' HD23 ' A' ' 82' ' ' LEU . . . -78.62 126.17 30.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.03 0.443 . . . . 4.54 110.795 179.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.543 ' HB ' ' HE1' ' A' ' 56' ' ' TYR . 6.9 m -85.86 116.79 24.32 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.721 0.772 . . . . 3.27 108.944 178.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.3 tp -72.09 151.31 43.16 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 114.787 -1.097 . . . . 1.89 109.928 -176.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.468 HD23 ' CE2' ' A' ' 56' ' ' TYR . 87.5 mt -93.97 130.09 40.21 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.225 -0.898 . . . . 1.38 112.076 -174.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.0 p -99.01 -173.83 2.61 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 106.478 -1.675 . . . . 1.29 106.478 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.6 m -56.72 -46.72 81.14 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 118.589 0.631 . . . . 1.31 109.866 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.27 -39.83 93.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.596 0.591 . . . . 1.65 112.596 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.14 -39.97 93.76 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 109.034 -0.728 . . . . 1.41 109.034 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.434 HD11 HD12 ' A' ' 74' ' ' LEU . 19.7 tp -66.17 -51.93 53.03 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 114.927 -1.033 . . . . 1.23 108.294 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.449 ' O ' HG22 ' A' ' 15' ' ' VAL . 37.7 ttm180 -46.98 -47.37 21.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.251 1.42 . . . . 3.04 111.498 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.571 ' HD2' HH22 ' A' ' 55' ' ' ARG . 29.1 ttm180 -56.39 -48.92 75.91 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.857 0.723 . . . . 4.47 110.291 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.21 -37.98 89.4 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.836 -0.62 . . . . 1.19 111.095 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.421 HD11 HG23 ' A' ' 48' ' ' THR . 4.4 mm? -62.93 -45.12 93.97 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.054 -0.351 . . . . 2.05 110.054 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.558 HG23 ' HA3' ' A' ' 23' ' ' GLY . 85.5 t -60.0 -52.39 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 109.73 -0.47 . . . . 1.33 109.73 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 42.0 mt-10 -57.55 -41.82 81.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.16 -0.473 . . . . 2.05 111.677 -178.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.531 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.0 m -77.26 -32.76 55.87 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 112.038 0.385 . . . . 1.66 112.038 -177.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.45 -19.65 52.69 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.344 0.592 . . . . 1.58 110.506 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.71 119.77 2.21 Favored Glycine 0 N--CA 1.428 -1.866 0 N-CA-C 110.03 -1.228 . . . . 2.32 110.03 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -5.46 1.86 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.357 1.614 . . . . 5.17 115.357 -176.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 t -70.83 -54.23 12.34 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.218 -0.446 . . . . 5.27 110.189 175.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.62 126.5 16.24 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.673 -0.862 . . . . 4.5 108.673 -175.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.558 ' HA3' HG23 ' A' ' 15' ' ' VAL . . . -91.99 51.33 2.85 Favored Glycine 0 CA--C 1.477 -2.309 0 C-N-CA 120.777 -0.725 . . . . 3.06 113.126 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.479 ' HB ' ' CD2' ' A' ' 26' ' ' LEU . 7.8 m 44.91 -116.74 0.55 Allowed 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 124.605 1.162 . . . . 3.17 112.388 172.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -122.36 28.75 7.27 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 123.494 0.718 . . . . 3.23 110.521 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.667 HD21 ' HH ' ' A' ' 40' ' ' TYR . 2.4 mm? -87.45 2.6 50.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.511 0.93 . . . . 1.6 113.511 -175.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -72.84 130.07 39.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.15 -1.055 . . . . 1.86 108.15 177.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 93.39 -168.58 29.66 Favored Glycine 0 N--CA 1.43 -1.757 0 N-CA-C 109.299 -1.52 . . . . 1.11 109.299 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -92.73 142.35 27.46 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 107.547 -1.279 . . . . 2.07 107.547 178.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 30.9 p90 -135.12 15.55 3.51 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.284 -0.566 . . . . 0.51 111.863 -174.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.569 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 65.0 mt -52.87 -24.86 9.97 Favored 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 116.115 1.895 . . . . 1.12 116.115 -175.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -95.21 -12.25 26.63 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.057 0.39 . . . . 2.04 111.798 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.3 mp -81.17 119.77 24.01 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.421 -0.585 . . . . 2.01 109.421 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 141.55 41.63 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.298 -1.001 . . . . 4.79 108.298 -178.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.455 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.5 m-85 -58.6 -37.95 76.95 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.47 0.481 . . . . 0.43 111.409 -176.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.49 -33.81 64.03 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.37 0.668 . . . . 2.79 111.364 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -82.62 -31.74 28.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.88 110.74 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.408 HG13 ' HD1' ' A' ' 40' ' ' TYR . 24.0 pt -93.16 22.52 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 N-CA-C 112.436 0.532 . . . . 1.25 112.436 -177.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.69 35.4 55.15 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.878 -0.601 . . . . 0.66 113.961 173.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.667 ' HH ' HD21 ' A' ' 26' ' ' LEU . 14.4 m-85 -108.24 116.9 32.82 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 112.582 0.586 . . . . 1.67 112.582 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -82.68 147.01 28.75 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 106.687 -1.597 . . . . 1.06 106.687 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 p -53.3 -35.93 60.65 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.754 1.02 . . . . 1.52 113.754 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.41 -46.93 71.75 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 109.273 -0.64 . . . . 2.24 109.273 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.435 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -61.45 -33.59 74.0 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.524 0.678 . . . . 1.13 110.33 176.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.412 ' O ' ' HB ' ' A' ' 48' ' ' THR . 51.4 tp -63.75 -51.27 65.65 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.436 -0.802 . . . . 1.15 109.95 175.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.5 mtm -63.79 -30.84 71.89 Favored 'General case' 0 C--O 1.206 -1.224 0 CA-C-N 116.36 -0.382 . . . . 2.13 111.227 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.435 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 8.5 tp10 -60.96 -37.89 83.98 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.551 1.14 . . . . 1.88 109.325 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.531 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 71.7 m -67.19 -56.7 8.83 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 113.998 -1.455 . . . . 1.18 107.953 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.518 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.69 -34.99 67.94 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.39 -1.277 . . . . 1.02 110.419 176.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.451 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -59.16 -41.93 89.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.303 0.641 . . . . 1.12 111.549 179.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.2 mtt180 -64.86 -42.0 95.23 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.792 -0.64 . . . . 3.59 109.33 176.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 49' ' ' ALA . 91.6 mt -61.71 -41.66 97.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.239 -0.437 . . . . 1.61 110.456 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.518 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.0 mt-10 -57.13 -56.38 22.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.878 -0.601 . . . . 0.48 110.139 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 t -62.77 -50.68 70.07 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.032 -0.986 . . . . 1.75 111.374 -177.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.571 HH22 ' HD2' ' A' ' 12' ' ' ARG . 65.4 ttt180 -63.26 -44.28 95.6 Favored 'General case' 0 C--N 1.313 -0.993 0 C-N-CA 125.05 1.34 . . . . 3.52 113.301 -175.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.543 ' HE1' ' HB ' ' A' ' 3' ' ' THR . 92.4 m-85 -97.07 -12.53 23.07 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.612 -0.835 . . . . 1.35 113.178 -176.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 56.65 2.95 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.109 -1.043 . . . . 0.93 110.594 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.46 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 12.6 p -139.51 176.3 6.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.676 -1.231 . . . . 1.72 107.676 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.432 ' H ' HG23 ' A' ' 58' ' ' VAL . 8.1 t -141.96 136.23 30.15 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.973 -1.121 . . . . 2.39 107.973 177.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.428 HD13 ' HB3' ' A' ' 49' ' ' ALA . 69.2 mt -124.14 126.57 25.55 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.328 -0.249 . . . . 1.21 110.328 -175.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.2 131.45 41.3 Favored 'Trans proline' 0 C--O 1.247 0.96 0 C-N-CA 122.836 2.357 . . . . 1.09 111.573 175.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.26 -40.65 64.78 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.935 1.294 . . . . 1.83 112.496 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -66.31 -40.89 90.27 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.111 -0.495 . . . . 2.34 111.002 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.2 t -72.63 -40.04 61.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 109.229 -0.656 . . . . 1.24 109.229 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.3 65.82 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.528 -0.76 . . . . 1.13 111.696 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.44 11.47 39.45 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.629 -0.796 . . . . 0.61 112.506 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.3 tpt180 -97.14 -20.0 18.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.698 0.761 . . . . 4.72 109.841 -177.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.497 HG22 HD21 ' A' ' 74' ' ' LEU . 24.3 m -79.2 117.11 24.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-N 115.093 -0.958 . . . . 1.15 112.229 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -94.4 -39.05 10.66 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 115.506 -0.77 . . . . 1.91 110.677 175.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 47.0 p -104.65 136.91 19.11 Favored Pre-proline 0 N--CA 1.407 -2.589 0 CA-C-N 115.723 -0.671 . . . . 1.16 111.112 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.569 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.8 Cg_exo -52.17 -35.69 63.86 Favored 'Trans proline' 0 CA--C 1.516 -0.411 0 C-N-CA 124.079 3.186 . . . . 0.36 113.787 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -53.42 -42.66 67.26 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.851 0.315 . . . . 1.84 111.851 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -65.14 -46.01 82.68 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.184 0.594 . . . . 2.13 110.55 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.497 HD21 HG22 ' A' ' 68' ' ' VAL . 3.4 tm? -65.84 -48.74 70.6 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.11 -0.95 . . . . 1.56 109.411 -178.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.01 -54.59 45.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 1.12 110.922 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.12 -40.61 98.11 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 112.626 0.602 . . . . 0.57 112.626 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.23 -48.65 80.5 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 108.86 -0.793 . . . . 2.48 108.86 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 65.9 mt -67.16 -35.16 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 116.074 -0.512 . . . . 1.19 110.702 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -57.41 -43.45 83.77 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 110.124 -0.324 . . . . 1.14 110.124 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.48 -40.22 97.52 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.825 -0.625 . . . . 0.53 111.919 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.5 -41.99 71.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.104 0.478 . . . . 1.22 111.032 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.444 HD23 ' HB3' ' A' ' 2' ' ' ALA . 62.5 mt -66.32 -31.43 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 1.97 111.855 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.84 -24.5 65.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.966 0.412 . . . . 1.26 111.688 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -81.09 -3.16 51.06 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.075 0.398 . . . . 2.44 112.075 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -130.42 9.42 5.13 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.904 0.859 . . . . 2.12 110.04 178.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.189 0 CA-C-N 115.643 -0.708 . . . . 3.84 109.106 -179.313 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 C--O 1.245 0.836 0 N-CA-C 109.471 -0.566 . . . . 6.86 109.471 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.84 76.44 0.33 Allowed 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 123.685 0.794 . . . . 4.54 110.469 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 9.0 t -105.27 122.08 45.2 Favored 'General case' 0 N--CA 1.42 -1.964 0 CA-C-N 115.693 -0.685 . . . . 3.27 109.672 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.77 125.85 25.69 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.459 -0.791 . . . . 1.89 109.813 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.481 ' O ' HD13 ' A' ' 75' ' ' LEU . 1.4 mm? -71.62 139.41 49.3 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.763 -1.108 . . . . 1.38 109.732 -176.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.7 p -97.64 -170.69 2.04 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 105.181 -2.155 . . . . 1.29 105.181 167.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.762 HG23 ' HA ' ' A' ' 29' ' ' ASP . 41.8 m -56.92 -47.54 80.37 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 119.244 0.929 . . . . 1.31 110.123 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.8 -48.36 79.94 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.977 -0.556 . . . . 1.65 112.387 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.412 ' HB3' HD12 ' A' ' 5' ' ' LEU . 16.2 m-20 -66.15 -38.6 88.5 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.134 -0.484 . . . . 1.41 110.484 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.401 HD11 ' CD1' ' A' ' 74' ' ' LEU . 16.5 tp -66.95 -46.8 73.58 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 108.4 -0.963 . . . . 1.23 108.4 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.4 ' O ' HG23 ' A' ' 15' ' ' VAL . 41.1 ttp180 -53.54 -46.48 70.2 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 123.792 0.837 . . . . 3.04 110.858 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.5 ttt180 -54.33 -50.55 67.13 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.391 0.432 . . . . 4.47 110.251 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.42 -40.65 95.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.752 -0.658 . . . . 1.19 111.351 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.409 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 10.2 mp -64.21 -44.03 93.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.875 -0.33 . . . . 2.05 111.786 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 11' ' ' ARG . 96.9 t -60.93 -45.42 98.38 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 N-CA-C 109.928 -0.397 . . . . 1.33 109.928 178.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 42.3 mt-10 -60.58 -47.52 85.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 2.05 110.955 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.527 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 38.9 m -65.38 -38.64 90.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.642 -0.708 . . . . 1.66 112.484 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.85 -46.36 78.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.383 -0.599 . . . . 1.58 109.383 178.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.15 -17.33 58.52 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 115.423 -0.808 . . . . 2.32 112.581 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -76.43 173.76 11.09 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 122.721 0.408 . . . . 5.17 111.653 -178.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -69.3 -92.78 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.842 -0.617 . . . . 5.27 112.294 -174.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -91.52 146.23 23.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.667 -0.864 . . . . 4.5 108.667 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.47 79.16 0.57 Allowed Glycine 0 N--CA 1.418 -2.517 0 CA-C-O 119.063 -0.854 . . . . 3.06 111.642 -177.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.8 p 37.19 -116.1 0.13 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.228 1.411 . . . . 3.17 113.122 174.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -118.94 17.46 13.36 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 106.567 -1.642 . . . . 3.23 106.567 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.487 ' CD1' HD13 ' A' ' 38' ' ' ILE . 16.4 tp -66.47 -27.13 67.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.54 -1.664 . . . . 1.6 109.412 -179.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.0 t -76.88 97.67 4.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.164 0.983 . . . . 1.86 110.887 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.24 -166.6 39.82 Favored Glycine 0 N--CA 1.428 -1.869 0 N-CA-C 106.521 -2.632 . . . . 1.11 106.521 177.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.762 ' HA ' HG23 ' A' ' 7' ' ' THR . 11.5 t70 -85.66 97.8 10.32 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.101 -1.815 . . . . 2.07 106.101 173.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -110.46 25.57 11.64 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.706 -0.679 . . . . 0.51 112.35 -169.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.762 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 50.6 mt -50.36 -27.75 6.84 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.061 1.874 . . . . 1.12 116.061 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -97.58 -5.19 36.18 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 118.43 0.559 . . . . 2.04 112.061 -177.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.416 HD23 HG21 ' A' ' 38' ' ' ILE . 9.4 mp -77.18 125.14 28.84 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.525 -0.734 . . . . 2.01 111.115 -177.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 69' ' ' ASP . 10.4 mpt_? -73.74 129.62 38.29 Favored 'General case' 0 C--O 1.247 0.951 0 N-CA-C 108.438 -0.949 . . . . 4.79 108.438 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.458 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 80.6 m-85 -55.05 -50.37 69.27 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.296 0.997 . . . . 0.43 113.399 -173.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -53.51 -27.04 23.43 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 113.179 0.807 . . . . 2.79 113.179 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.78 -33.05 27.44 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.371 0.605 . . . . 0.88 110.187 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.487 HD13 ' CD1' ' A' ' 26' ' ' LEU . 12.6 pt -96.75 22.81 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 112.958 0.725 . . . . 1.25 112.958 -175.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.17 21.77 54.02 Favored Glycine 0 CA--C 1.506 -0.483 0 CA-C-N 115.799 -0.637 . . . . 0.66 113.997 174.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 26.6 m-85 -123.06 102.6 8.08 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 112.023 0.379 . . . . 1.67 112.023 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -82.34 147.22 28.96 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 106.914 -1.513 . . . . 1.06 106.914 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.575 ' O ' ' HG3' ' A' ' 46' ' ' MET . 23.8 m -50.01 -22.44 1.59 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.839 1.051 . . . . 1.52 113.839 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.57 -58.76 5.46 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.764 -0.585 . . . . 2.24 110.006 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.489 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -62.68 -26.83 68.86 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.645 0.736 . . . . 1.13 109.86 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.564 HD23 HG23 ' A' ' 68' ' ' VAL . 28.8 tp -64.28 -47.23 80.32 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 115.393 -0.821 . . . . 1.15 110.251 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' ' 42' ' ' SER . 56.0 mtm -63.58 -33.12 74.89 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 110.051 -0.352 . . . . 2.13 110.051 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 10.9 tp10 -60.55 -37.82 82.48 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 121.957 0.884 . . . . 1.88 109.349 176.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.446 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 79.4 m -70.14 -55.98 8.03 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.319 -1.309 . . . . 1.18 107.866 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.629 ' HA ' HD11 ' A' ' 52' ' ' LEU . . . -54.9 -36.03 64.76 Favored 'General case' 0 C--O 1.203 -1.356 0 CA-C-N 114.0 -1.455 . . . . 1.02 110.809 178.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.52 83.62 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-O 121.538 0.685 . . . . 1.12 112.015 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.527 ' CZ ' ' HA ' ' A' ' 17' ' ' SER . 77.6 mtt180 -68.9 -37.83 79.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.279 -0.873 . . . . 3.59 109.599 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.629 HD11 ' HA ' ' A' ' 49' ' ' ALA . 56.8 mt -62.75 -46.32 88.6 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.903 -1.044 . . . . 1.61 109.557 176.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -55.98 -58.06 9.49 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.606 -0.725 . . . . 0.48 111.218 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.0 t -63.13 -56.37 17.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.38 -0.827 . . . . 1.75 112.284 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.533 ' HD2' ' CZ ' ' A' ' 56' ' ' TYR . 35.5 ttm180 -65.02 -43.82 91.18 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.769 0.655 . . . . 3.52 112.769 -173.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.533 ' CZ ' ' HD2' ' A' ' 55' ' ' ARG . 61.7 m-85 -98.04 -3.26 38.45 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.175 -0.61 . . . . 1.35 112.514 -173.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.62 43.42 43.87 Favored Glycine 0 C--N 1.318 -0.425 0 C-N-CA 120.645 -0.788 . . . . 0.93 112.822 176.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.4 p -114.91 143.15 25.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 N-CA-C 109.421 -0.585 . . . . 1.72 109.421 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 m -99.74 120.35 39.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 109.126 -0.694 . . . . 2.39 109.126 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.1 mt -126.56 107.39 23.4 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 109.434 -0.58 . . . . 1.21 109.434 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.68 141.75 97.92 Favored 'Trans proline' 0 C--O 1.242 0.691 0 C-N-CA 122.324 2.016 . . . . 1.09 110.97 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -52.2 -39.84 60.72 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.432 1.093 . . . . 1.83 112.465 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.676 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 32.8 t70 -69.01 -38.81 79.45 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.58 -0.282 . . . . 2.34 110.88 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.6 t -69.97 -38.29 74.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.897 -0.779 . . . . 1.24 108.897 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -21.42 59.03 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.58 -0.736 . . . . 1.13 111.819 176.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.3 7.74 28.69 Favored Glycine 0 N--CA 1.442 -0.941 0 C-N-CA 121.162 -0.542 . . . . 0.61 112.219 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 24.3 mmm180 -101.31 -15.55 17.22 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.541 0.686 . . . . 4.72 109.958 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.564 HG23 HD23 ' A' ' 45' ' ' LEU . 30.9 m -78.07 101.39 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-O 122.456 1.122 . . . . 1.15 109.42 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.45 ' OD2' HG22 ' A' ' 70' ' ' THR . 8.5 t70 -88.2 -25.76 22.74 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.041 -1.436 . . . . 1.91 111.262 -177.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.45 HG22 ' OD2' ' A' ' 69' ' ' ASP . 30.1 p -133.62 147.39 64.39 Favored Pre-proline 0 N--CA 1.422 -1.838 0 CA-C-N 115.432 -0.804 . . . . 1.16 108.944 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.762 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 57.1 Cg_exo -55.7 -35.77 93.8 Favored 'Trans proline' 0 C--O 1.208 -0.98 0 C-N-CA 123.302 2.668 . . . . 0.36 112.037 177.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.572 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 9.8 ptm180 -54.33 -39.8 67.4 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 123.209 0.318 . . . . 1.84 111.615 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -67.33 -48.78 66.52 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 121.544 0.688 . . . . 2.13 110.693 174.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.513 HD23 HG22 ' A' ' 68' ' ' VAL . 3.2 tm? -66.35 -48.19 71.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.636 -1.165 . . . . 1.56 111.682 -174.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 5' ' ' LEU . 31.3 tp -57.02 -47.53 80.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 123.027 0.531 . . . . 1.12 109.709 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.21 -43.18 96.17 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.055 -0.975 . . . . 0.57 111.303 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.42 -48.82 79.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.793 -0.639 . . . . 2.48 109.536 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.408 ' CD1' HD13 ' A' ' 52' ' ' LEU . 49.1 mt -65.76 -43.08 93.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 N-CA-C 110.359 -0.237 . . . . 1.19 110.359 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.06 -43.01 91.67 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 120.785 -0.366 . . . . 1.14 110.445 177.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.7 -40.05 93.83 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 116.056 -0.52 . . . . 0.53 112.301 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.18 71.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.076 0.465 . . . . 1.22 110.518 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.9 mt -70.3 -16.53 63.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.083 -0.508 . . . . 1.97 112.001 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.99 66.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.865 0.364 . . . . 1.26 110.688 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -86.58 -11.48 51.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.428 -0.351 . . . . 2.44 111.111 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.62 79.09 5.05 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.941 0.877 . . . . 2.12 110.294 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.947 0 N-CA-C 106.391 -1.707 . . . . 3.84 106.391 179.966 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.7 mtp . . . . . 0 CA--C 1.501 -0.906 0 N-CA-C 108.836 -0.802 . . . . 6.86 108.836 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.38 97.68 6.02 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 120.326 -0.55 . . . . 4.54 110.395 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.517 ' HB ' ' HE1' ' A' ' 56' ' ' TYR . 21.6 m -77.87 106.63 9.84 Favored 'General case' 0 CA--C 1.491 -1.326 0 N-CA-C 106.681 -1.6 . . . . 3.27 106.681 174.219 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.8 tp -86.39 157.66 19.8 Favored 'General case' 0 N--CA 1.389 -3.491 0 CA-C-N 113.641 -1.618 . . . . 1.89 109.393 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.439 ' O ' HD11 ' A' ' 75' ' ' LEU . 84.8 mt -106.74 126.36 52.2 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 108.901 -0.777 . . . . 1.38 108.901 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -93.42 -173.35 3.19 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.074 -1.454 . . . . 1.29 107.074 171.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.895 HG22 ' HA ' ' A' ' 29' ' ' ASP . 11.0 m -56.96 -47.14 81.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.087 -0.709 . . . . 1.31 109.087 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -58.74 -47.34 84.94 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.226 -0.897 . . . . 1.65 112.055 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -66.29 -32.29 73.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 120.652 -0.419 . . . . 1.41 110.489 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.405 HD13 ' CD1' ' A' ' 74' ' ' LEU . 17.8 tp -68.09 -46.73 70.18 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.807 -0.812 . . . . 1.23 108.807 178.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.567 ' O ' HG23 ' A' ' 15' ' ' VAL . 47.3 ttp180 -51.57 -48.39 63.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.791 -0.64 . . . . 3.04 110.574 176.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.477 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.7 ttm105 -53.39 -43.4 67.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 115.479 -0.782 . . . . 4.47 111.54 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.76 98.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.032 0.444 . . . . 1.19 110.614 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.465 HD12 HG23 ' A' ' 48' ' ' THR . 10.2 mp -65.95 -37.43 86.01 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.939 -0.573 . . . . 2.05 110.893 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 11' ' ' ARG . 16.5 t -71.47 -36.6 61.24 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 121.462 0.648 . . . . 1.33 109.398 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 60.3 mm-40 -64.04 -34.17 77.4 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.65 -0.657 . . . . 2.05 111.065 176.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.1 t -84.02 -52.43 6.32 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 116.309 -0.405 . . . . 1.66 111.498 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.5 0.72 24.89 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 113.087 0.773 . . . . 1.58 113.087 -173.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.47 -147.62 42.5 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 110.407 -1.077 . . . . 2.32 110.407 -177.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.92 13.63 33.22 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 121.463 0.649 . . . . 5.17 109.496 175.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 m -70.8 -71.13 0.26 Allowed 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.977 -1.49 . . . . 5.27 106.977 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -86.52 108.0 18.35 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.194 -1.41 . . . . 4.5 107.194 172.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.62 60.89 0.03 OUTLIER Glycine 0 CA--C 1.462 -3.268 0 N-CA-C 109.158 -1.577 . . . . 3.06 109.158 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -93.81 83.13 4.35 Favored 'General case' 0 N--CA 1.394 -3.235 0 CA-C-N 113.921 -1.139 . . . . 3.17 110.48 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 74.42 60.11 0.08 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.761 1.224 . . . . 3.23 111.935 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HG ' ' CD2' ' A' ' 30' ' ' PHE . 9.6 mp -100.09 -5.11 28.43 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.958 -1.019 . . . . 1.6 110.657 178.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m -71.21 139.19 50.04 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.531 -0.758 . . . . 1.86 109.749 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.48 -117.43 4.84 Favored Glycine 0 CA--C 1.499 -0.934 0 N-CA-C 109.923 -1.271 . . . . 1.11 109.923 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.895 ' HA ' HG22 ' A' ' 7' ' ' THR . 17.4 m-20 -126.33 113.14 16.53 Favored 'General case' 0 CA--C 1.487 -1.452 0 CA-C-N 117.403 0.601 . . . . 2.07 109.821 177.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.411 ' CD2' ' HG ' ' A' ' 26' ' ' LEU . 18.1 p90 -112.88 9.91 18.96 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.547 -0.751 . . . . 0.51 109.98 179.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.828 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 59.0 mt -52.93 -24.85 10.15 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.86 1.43 . . . . 1.12 114.86 -177.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -93.25 -19.94 20.91 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 120.819 0.342 . . . . 2.04 110.547 -176.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.5 mp -77.89 125.0 28.69 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 109.347 -0.612 . . . . 2.01 109.347 -176.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -74.85 135.61 41.58 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.743 -0.836 . . . . 4.79 108.743 -177.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -56.85 -46.65 81.6 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.354 0.409 . . . . 0.43 109.914 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -55.08 -28.54 53.18 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.156 0.982 . . . . 2.79 111.247 178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -85.59 -32.83 21.88 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.812 -0.631 . . . . 0.88 111.873 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -96.26 30.4 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 113.836 1.051 . . . . 1.25 113.836 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.96 -16.78 60.6 Favored Glycine 0 C--N 1.316 -0.531 0 C-N-CA 120.587 -0.816 . . . . 0.66 113.521 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.431 ' CZ ' HD23 ' A' ' 14' ' ' LEU . 35.5 m-85 -81.61 163.93 22.22 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.718 0.771 . . . . 1.67 111.578 -177.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -135.46 140.84 45.17 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.088 -1.819 . . . . 1.06 106.088 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 46' ' ' MET . 57.6 p -48.45 -32.57 7.96 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 124.562 1.145 . . . . 1.52 113.641 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.814 ' HA ' ' HE2' ' A' ' 46' ' ' MET . 6.1 tt -64.98 -50.63 65.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.482 -0.562 . . . . 2.24 109.482 177.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 -36.15 81.61 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.41 0.624 . . . . 1.13 110.293 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.532 HD21 HG21 ' A' ' 68' ' ' VAL . 61.0 tp -61.25 -37.15 82.05 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.83 -1.077 . . . . 1.15 110.54 179.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.814 ' HE2' ' HA ' ' A' ' 43' ' ' LEU . 70.0 mtm -63.1 -33.1 74.72 Favored 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 111.884 0.327 . . . . 2.13 111.884 178.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.66 -37.42 87.52 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.09 0.948 . . . . 1.88 109.468 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.465 HG23 HD12 ' A' ' 14' ' ' LEU . 31.2 m -66.94 -54.6 20.41 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.295 -1.321 . . . . 1.18 108.073 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.484 ' HB1' HD13 ' A' ' 60' ' ' ILE . . . -57.63 -34.81 69.71 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 114.916 -1.038 . . . . 1.02 110.044 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.94 -41.9 88.48 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 123.237 0.615 . . . . 1.12 111.322 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 mtp180 -64.93 -40.71 95.46 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 115.34 -0.845 . . . . 3.59 110.024 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.96 -41.14 97.65 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.974 -0.557 . . . . 1.61 110.922 178.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.5 mt-10 -56.58 -55.0 39.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 123.686 0.616 . . . . 0.48 109.58 174.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -63.87 -42.44 97.51 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.097 -0.956 . . . . 1.75 111.757 -177.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -65.15 -51.91 58.35 Favored 'General case' 0 C--O 1.215 -0.725 0 C-N-CA 123.034 0.534 . . . . 3.52 111.636 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.517 ' HE1' ' HB ' ' A' ' 3' ' ' THR . 92.3 m-85 -93.68 -7.74 42.9 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 113.52 0.933 . . . . 1.35 113.52 -171.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.92 53.95 4.71 Favored Glycine 0 C--N 1.312 -0.793 0 C-N-CA 120.458 -0.877 . . . . 0.93 111.357 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.438 HG23 ' H ' ' A' ' 59' ' ' SER . 9.9 p -139.5 176.33 6.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.001 -1.111 . . . . 1.72 108.001 -177.349 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.438 ' H ' HG23 ' A' ' 58' ' ' VAL . 12.1 p -141.81 140.92 33.11 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 118.624 0.647 . . . . 2.39 110.422 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.484 HD13 ' HB1' ' A' ' 49' ' ' ALA . 61.2 mt -126.25 123.32 24.25 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.096 -1.076 . . . . 1.21 108.096 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.57 128.07 25.87 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.361 2.041 . . . . 1.09 110.1 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.66 -27.86 29.9 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.962 0.905 . . . . 1.83 113.355 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -67.2 -44.71 78.94 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.495 -0.557 . . . . 2.34 109.495 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.89 -41.94 60.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.852 -0.796 . . . . 1.24 108.852 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.98 -27.82 63.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.68 -0.691 . . . . 1.13 111.854 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.35 -1.51 47.49 Favored Glycine 0 N--CA 1.44 -1.087 0 C-N-CA 120.437 -0.887 . . . . 0.61 112.052 177.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -99.57 -10.55 21.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.295 0.569 . . . . 4.72 110.549 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.532 HG21 HD21 ' A' ' 45' ' ' LEU . 13.2 m -79.32 103.82 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.805 0 CA-C-O 121.582 0.706 . . . . 1.15 110.041 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.93 -40.36 14.88 Favored 'General case' 0 CA--C 1.482 -1.67 0 CA-C-N 115.523 -0.762 . . . . 1.91 110.862 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.1 p -107.86 133.03 20.62 Favored Pre-proline 0 N--CA 1.402 -2.865 0 CA-C-N 115.261 -0.881 . . . . 1.16 110.153 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.828 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.7 Cg_exo -50.71 -31.75 33.71 Favored 'Trans proline' 0 C--O 1.213 -0.755 0 C-N-CA 123.867 3.045 . . . . 0.36 113.285 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.409 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 11.5 ptp85 -52.94 -48.1 67.57 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 120.923 0.392 . . . . 1.84 110.781 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 10.5 mm-40 -66.15 -41.45 90.38 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 123.88 0.872 . . . . 2.13 110.651 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.51 HD21 HG23 ' A' ' 68' ' ' VAL . 3.0 tm? -68.26 -45.55 72.85 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.092 -0.958 . . . . 1.56 109.454 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.439 HD11 ' O ' ' A' ' 5' ' ' LEU . 32.3 tp -57.16 -51.9 67.45 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.724 -0.671 . . . . 1.12 109.392 178.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -56.65 -45.0 81.86 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.044 0.938 . . . . 0.57 112.1 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.39 -49.33 77.32 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.296 -0.631 . . . . 2.48 109.296 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.444 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 61.6 mt -66.88 -45.21 88.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 116.168 -0.469 . . . . 1.19 110.396 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -45.95 71.77 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.563 0.345 . . . . 1.14 110.671 177.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.6 -42.56 97.31 Favored Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.887 -0.597 . . . . 0.53 112.377 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.62 -38.28 80.42 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.323 0.249 . . . . 1.22 110.818 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 80.3 mt -60.79 -46.18 91.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.385 0.612 . . . . 1.97 110.28 177.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.38 65.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.672 -0.695 . . . . 1.26 111.548 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -98.59 7.21 46.4 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-O 121.848 0.832 . . . . 2.44 110.756 -177.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -94.56 18.49 11.32 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.732 -0.605 . . . . 2.12 110.463 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 C-N-CA 125.119 1.368 . . . . 3.84 110.01 -177.083 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.506 -0.719 0 N-CA-C 108.673 -0.862 . . . . 6.86 108.673 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.601 ' HB2' ' HG ' ' A' ' 82' ' ' LEU . . . -140.19 104.56 4.84 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 121.209 0.528 . . . . 4.54 111.287 -178.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 80.7 m -93.55 118.7 31.69 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 107.998 -1.112 . . . . 3.27 107.998 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 tp -56.63 149.36 17.82 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 113.857 -1.519 . . . . 1.89 112.075 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.08 127.07 35.99 Favored 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 114.865 -1.061 . . . . 1.38 109.827 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -101.2 179.82 4.26 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 107.07 -1.455 . . . . 1.29 107.07 170.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.847 HG22 ' HA ' ' A' ' 29' ' ' ASP . 19.4 m -58.29 -40.88 83.14 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.413 0.625 . . . . 1.31 109.594 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.39 -53.7 55.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 114.747 -1.115 . . . . 1.65 111.237 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.471 ' O ' ' HB3' ' A' ' 12' ' ' ARG . 8.5 t70 -69.6 -33.23 72.39 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 121.293 0.568 . . . . 1.41 110.395 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.483 HD11 HD12 ' A' ' 74' ' ' LEU . 17.8 tp -65.32 -45.89 82.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.158 -0.682 . . . . 1.23 109.158 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 15' ' ' VAL . 45.4 ttp180 -54.25 -43.91 71.34 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 123.937 0.895 . . . . 3.04 109.978 176.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 53.6 ttt180 -54.84 -45.82 74.54 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 115.163 -0.926 . . . . 4.47 110.726 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.438 ' HB2' HD23 ' A' ' 52' ' ' LEU . . . -61.05 -40.65 94.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.094 -0.503 . . . . 1.19 111.148 -178.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -64.78 -44.2 90.74 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 121.105 -0.238 . . . . 2.05 111.201 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 11' ' ' ARG . 60.6 t -63.19 -47.95 89.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.284 -0.416 . . . . 1.33 110.019 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.04 -32.17 73.47 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.832 0.308 . . . . 2.05 111.832 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.492 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 35.7 t -74.45 -52.96 10.52 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.773 0.321 . . . . 1.66 111.395 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.78 -44.45 61.55 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.308 -0.405 . . . . 1.58 111.614 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.38 -125.55 8.16 Favored Glycine 0 N--CA 1.429 -1.773 0 N-CA-C 109.577 -1.409 . . . . 2.32 109.577 -177.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -84.77 102.77 13.29 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.306 0.574 . . . . 5.17 111.155 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.2 t -139.28 -156.19 0.66 Allowed 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.042 -1.466 . . . . 5.27 107.042 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -122.3 123.43 41.41 Favored 'General case' 0 C--N 1.293 -1.86 0 N-CA-C 109.391 -0.596 . . . . 4.5 109.391 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.28 63.89 4.27 Favored Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 110.907 -0.877 . . . . 3.06 110.907 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.448 HG21 HG21 ' A' ' 38' ' ' ILE . 9.2 t -59.89 92.91 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.416 1.086 . . . . 3.17 111.467 -177.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 64.61 24.95 13.08 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 114.404 -1.271 . . . . 3.23 110.405 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.2 tp -76.75 -33.66 58.1 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.874 -1.057 . . . . 1.6 109.581 -176.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.0 m -61.05 133.91 56.54 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.063 -0.971 . . . . 1.86 110.436 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.36 -136.86 14.01 Favored Glycine 0 N--CA 1.433 -1.528 0 N-CA-C 110.457 -1.057 . . . . 1.11 110.457 -176.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.847 ' HA ' HG22 ' A' ' 7' ' ' THR . 4.2 m-20 -100.1 98.84 9.51 Favored 'General case' 0 CA--C 1.49 -1.359 0 CA-C-O 121.319 0.581 . . . . 2.07 110.638 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.419 ' HA ' HD21 ' A' ' 33' ' ' LEU . 21.7 p90 -95.35 13.26 26.31 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.391 -0.822 . . . . 0.51 110.144 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.707 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 58.6 mt -50.82 -23.95 3.14 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.82 1.785 . . . . 1.12 115.82 -175.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.98 -8.93 32.39 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.39 0.614 . . . . 2.04 111.414 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.419 HD21 ' HA ' ' A' ' 30' ' ' PHE . 3.9 mm? -79.12 123.72 27.63 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.612 -0.514 . . . . 2.01 109.612 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -75.48 141.52 43.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.175 -1.046 . . . . 4.79 108.175 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.403 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.6 m-85 -59.99 -41.38 91.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 110.278 -0.268 . . . . 0.43 110.278 -178.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -57.76 -27.37 62.99 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.355 0.597 . . . . 2.79 111.344 176.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -84.79 -33.96 22.88 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.094 0.473 . . . . 0.88 110.895 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.448 HG21 HG21 ' A' ' 24' ' ' THR . 27.2 pt -93.15 16.91 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.634 0.605 . . . . 1.25 112.634 -178.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.79 43.18 18.84 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 116.059 -0.519 . . . . 0.66 113.411 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.403 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 15.2 m-85 -126.93 117.09 21.84 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 122.684 -0.304 . . . . 1.67 111.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.43 151.85 24.39 Favored 'General case' 0 CA--C 1.474 -1.956 0 N-CA-C 108.269 -1.011 . . . . 1.06 108.269 171.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.414 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 15.7 p -53.45 -30.35 40.15 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.616 0.969 . . . . 1.52 113.616 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.76 -54.59 36.84 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.625 -0.88 . . . . 2.24 108.625 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.06 80.16 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.053 0.541 . . . . 1.13 111.064 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.529 ' O ' ' HB ' ' A' ' 48' ' ' THR . 65.0 tp -64.3 -41.07 97.04 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.907 -0.588 . . . . 1.15 110.912 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 71.4 mtm -64.28 -31.73 73.05 Favored 'General case' 0 C--O 1.196 -1.723 0 O-C-N 122.026 -0.422 . . . . 2.13 111.541 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.563 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 9.3 tp10 -63.58 -33.03 74.7 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.731 0.777 . . . . 1.88 109.237 174.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.529 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 39.7 m -66.4 -55.32 16.36 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.398 -1.334 . . . . 1.18 107.398 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.426 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.06 -39.69 75.41 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-N 114.345 -1.298 . . . . 1.02 109.888 175.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.25 -45.98 86.79 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 123.775 0.83 . . . . 1.12 111.95 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.563 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 56.4 mtt180 -65.03 -37.15 86.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.707 -0.679 . . . . 3.59 109.908 178.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' A' ' 13' ' ' ALA . 81.3 mt -65.59 -38.94 90.93 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 116.049 -0.523 . . . . 1.61 111.039 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.6 mt-10 -56.6 -55.08 38.5 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.626 0.579 . . . . 0.48 109.482 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 m -62.07 -40.61 96.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.518 -0.764 . . . . 1.75 112.136 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -66.09 -49.46 67.52 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.124 -0.489 . . . . 3.52 112.14 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -98.51 -11.16 22.54 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.947 1.462 . . . . 1.35 114.947 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.74 53.08 6.66 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.415 -0.898 . . . . 0.93 111.188 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.6 p -135.24 137.49 50.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 0 N-CA-C 108.448 -0.945 . . . . 1.72 108.448 -177.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.4 m -96.57 114.54 26.21 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 120.722 0.296 . . . . 2.39 110.7 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.2 mt -104.62 122.24 44.28 Favored Pre-proline 0 C--N 1.32 -0.695 0 C-N-CA 122.931 0.492 . . . . 1.21 109.969 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -67.78 131.73 24.95 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.956 2.437 . . . . 1.09 112.07 178.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -52.06 -40.51 61.26 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.848 1.259 . . . . 1.83 113.742 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.44 -37.85 83.63 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.901 -0.32 . . . . 2.34 110.533 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 34.0 t -75.23 -42.01 44.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.891 -0.781 . . . . 1.24 108.891 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.88 -32.05 69.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.603 -0.726 . . . . 1.13 111.386 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.87 9.68 63.97 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.73 -0.748 . . . . 0.61 112.273 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -100.41 -24.13 14.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.952 0.406 . . . . 4.72 110.292 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.503 HG22 HD22 ' A' ' 74' ' ' LEU . 20.8 m -75.68 103.88 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 CA-C-O 122.029 0.918 . . . . 1.15 111.032 -177.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.74 -30.32 20.4 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-N 115.132 -0.94 . . . . 1.91 111.488 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.403 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 38.4 p -122.51 145.53 45.04 Favored Pre-proline 0 N--CA 1.419 -1.981 0 CA-C-N 115.946 -0.57 . . . . 1.16 109.836 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.707 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.4 Cg_exo -53.07 -40.73 75.77 Favored 'Trans proline' 0 CA--C 1.509 -0.773 0 C-N-CA 124.023 3.148 . . . . 0.36 114.024 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.9 ptp85 -52.36 -39.78 61.17 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 123.495 0.497 . . . . 1.84 111.663 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.22 -51.55 63.15 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.933 -0.576 . . . . 2.13 109.837 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.503 HD22 HG22 ' A' ' 68' ' ' VAL . 3.4 tm? -67.34 -39.76 85.83 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.619 -1.173 . . . . 1.56 110.213 -176.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 48.0 tp -56.91 -57.67 11.5 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 109.219 -0.659 . . . . 1.12 109.219 177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.87 -37.86 74.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 123.766 0.666 . . . . 0.57 111.438 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -59.57 -53.08 62.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.682 -0.69 . . . . 2.48 110.439 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.487 HG23 HD13 ' A' ' 82' ' ' LEU . 44.9 mt -76.08 -21.92 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 C-N-CA 120.364 -0.534 . . . . 1.19 110.53 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -64.83 -50.29 67.28 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.853 -0.795 . . . . 1.14 108.853 173.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.66 -38.24 95.41 Favored Glycine 0 N--CA 1.439 -1.125 0 CA-C-N 115.249 -0.887 . . . . 0.53 111.668 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.75 -39.11 84.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.433 0.159 . . . . 1.22 110.845 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.601 ' HG ' ' HB2' ' A' ' 2' ' ' ALA . 5.3 mp -70.86 -39.01 73.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 122.357 0.263 . . . . 1.97 111.4 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.7 -34.14 77.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.567 0.698 . . . . 1.26 110.019 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -78.39 -20.14 51.84 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.458 -0.792 . . . . 2.44 110.145 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.82 -15.3 58.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.246 0.461 . . . . 2.12 112.246 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.319 0 N-CA-C 109.356 -0.609 . . . . 3.84 109.356 178.656 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.1 mmm . . . . . 0 CA--C 1.511 -0.545 0 N-CA-C 108.885 -0.783 . . . . 6.86 108.885 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.33 -67.21 0.6 Allowed 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.237 -0.653 . . . . 4.54 109.237 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 31.3 p -128.07 102.51 6.76 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 119.779 -0.769 . . . . 3.27 109.353 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.508 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 22.6 tp 151.42 156.7 0.0 OUTLIER 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 103.616 -2.735 . . . . 1.89 103.616 177.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.508 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 94.9 mt -117.35 124.22 48.39 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 108.157 -1.053 . . . . 1.38 108.157 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.9 p -97.6 -171.38 2.17 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 107.836 -1.172 . . . . 1.29 107.836 170.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.1 m -52.25 -54.98 24.33 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 123.891 0.876 . . . . 1.31 111.436 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.42 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . 32.1 t70 -72.07 -28.13 63.13 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 112.713 0.634 . . . . 1.65 112.713 -178.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.47 -44.98 85.45 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.573 -0.899 . . . . 1.41 108.573 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.68 -47.39 75.63 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.626 -1.17 . . . . 1.23 108.881 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.42 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 36.7 ttt-85 -49.54 -51.51 36.13 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.343 1.057 . . . . 3.04 110.963 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 65.6 ttt180 -59.08 -50.58 73.54 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.435 -0.348 . . . . 4.47 111.581 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.26 -36.22 77.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.13 -0.486 . . . . 1.19 111.323 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.59 HD21 HG22 ' A' ' 48' ' ' THR . 99.1 mt -63.34 -53.52 51.37 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.523 0.514 . . . . 2.05 110.169 177.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.517 ' HA ' HG22 ' A' ' 21' ' ' THR . 94.6 t -57.97 -45.92 87.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.949 -0.569 . . . . 1.33 111.355 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.602 ' HB2' HH12 ' A' ' 51' ' ' ARG . 55.6 mt-10 -60.87 -30.46 70.15 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.503 -0.317 . . . . 2.05 111.723 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 m -89.77 -33.61 16.49 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.128 -0.229 . . . . 1.66 111.428 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.51 -29.85 52.66 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 120.813 0.339 . . . . 1.58 111.258 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.57 -82.77 1.65 Allowed Glycine 0 C--O 1.245 0.819 0 N-CA-C 110.846 -0.901 . . . . 2.32 110.846 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -98.08 111.9 24.05 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.468 -0.938 . . . . 5.17 108.468 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.517 HG22 ' HA ' ' A' ' 15' ' ' VAL . 4.2 t -156.19 109.3 2.66 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-O 122.587 1.184 . . . . 5.27 111.063 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -98.62 -59.58 1.71 Allowed 'General case' 0 C--N 1.282 -2.358 0 CA-C-N 113.858 -1.519 . . . . 4.5 107.719 174.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.71 -73.99 0.95 Allowed Glycine 0 N--CA 1.434 -1.499 0 CA-C-N 115.149 -0.932 . . . . 3.06 112.582 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t 176.74 -149.78 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 104.552 -2.388 . . . . 3.17 104.552 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -81.72 109.42 16.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 107.645 -1.243 . . . . 3.23 107.645 172.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.0 tp -96.54 -3.03 43.87 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.734 -1.121 . . . . 1.6 109.131 -174.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 p -81.0 140.18 35.34 Favored 'General case' 0 N--CA 1.416 -2.173 0 CA-C-N 114.331 -1.304 . . . . 1.86 110.953 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.19 -143.19 16.39 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.902 -0.879 . . . . 1.11 110.902 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -89.26 98.47 11.78 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 109.264 -0.643 . . . . 2.07 109.264 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -100.36 3.66 43.43 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.921 -0.77 . . . . 0.51 108.921 176.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.634 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 41.4 mt -54.2 -26.68 29.59 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.541 1.136 . . . . 1.12 113.99 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -90.32 -19.31 24.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.733 0.778 . . . . 2.04 110.445 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -81.96 123.71 29.12 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.317 -0.994 . . . . 2.01 108.317 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.63 146.0 42.79 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 116.278 -0.419 . . . . 4.79 110.292 -176.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 70.2 m-85 -61.94 -32.91 73.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.342 0.591 . . . . 0.43 109.543 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -54.72 -40.68 69.48 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.739 -1.119 . . . . 2.79 110.182 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -81.1 -33.34 33.39 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.941 -1.027 . . . . 0.88 111.06 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.521 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.5 pt -92.14 19.55 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 112.26 0.467 . . . . 1.25 112.26 -177.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 69.34 46.33 57.15 Favored Glycine 0 CA--C 1.511 -0.177 0 CA-C-N 116.122 -0.49 . . . . 0.66 113.626 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.528 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 7.7 m-85 -118.86 124.89 48.25 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 120.724 0.297 . . . . 1.67 111.502 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -84.7 134.1 34.36 Favored 'General case' 0 CA--C 1.484 -1.572 0 N-CA-C 107.709 -1.219 . . . . 1.06 107.709 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.498 ' O ' ' HB3' ' A' ' 45' ' ' LEU . 15.9 m -53.63 -26.12 20.72 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 123.607 0.567 . . . . 1.52 111.418 174.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.7 tp -64.7 -49.89 69.13 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.78 -0.575 . . . . 2.24 110.099 174.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.86 73.28 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 122.128 0.966 . . . . 1.13 109.702 177.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.587 HD21 HG22 ' A' ' 68' ' ' VAL . 33.8 tp -62.77 -50.64 70.23 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.49 -1.232 . . . . 1.15 108.957 176.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.467 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.9 mtp -62.56 -33.29 74.66 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.264 -0.425 . . . . 2.13 110.823 176.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.71 -36.59 81.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 122.159 0.981 . . . . 1.88 108.757 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.59 HG22 HD21 ' A' ' 14' ' ' LEU . 89.3 m -68.57 -57.65 5.44 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.245 -1.391 . . . . 1.18 107.245 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.606 ' HA ' HD11 ' A' ' 52' ' ' LEU . . . -54.82 -33.02 61.08 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.908 -1.496 . . . . 1.02 111.07 178.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.65 -46.92 83.57 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.154 0.502 . . . . 1.12 111.567 178.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.602 HH12 ' HB2' ' A' ' 16' ' ' GLU . 66.7 mtp180 -64.07 -37.79 88.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.307 -0.861 . . . . 3.59 109.634 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.606 HD11 ' HA ' ' A' ' 49' ' ' ALA . 65.1 mt -66.14 -47.97 72.31 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 1.61 110.295 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.9 mt-10 -58.43 -40.58 82.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.903 0.383 . . . . 0.48 110.246 175.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.8 t -61.26 -64.39 0.97 Allowed 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.203 -0.908 . . . . 1.75 111.005 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -63.86 -41.67 97.72 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.354 0.872 . . . . 3.52 113.354 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -93.2 -4.5 51.9 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 112.999 0.741 . . . . 1.35 112.999 -171.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.86 26.06 72.07 Favored Glycine 0 C--O 1.239 0.456 0 C-N-CA 120.981 -0.628 . . . . 0.93 112.562 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.764 HG12 ' HB3' ' A' ' 85' ' ' ALA . 28.9 m -99.15 173.96 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.937 -0.132 . . . . 1.72 110.749 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.2 p -141.9 113.68 7.91 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-O 121.421 0.629 . . . . 2.39 112.05 -176.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.473 HD12 ' HB2' ' A' ' 49' ' ' ALA . 63.4 mt -103.92 127.29 29.65 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 108.509 -0.923 . . . . 1.21 108.509 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.72 136.66 68.04 Favored 'Trans proline' 0 C--O 1.242 0.681 0 C-N-CA 122.37 2.047 . . . . 1.09 110.645 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -52.72 -41.87 64.35 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.902 0.704 . . . . 1.83 112.902 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.28 -32.51 72.72 Favored 'General case' 0 C--O 1.183 -2.429 0 CA-C-N 116.481 -0.327 . . . . 2.34 110.447 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.6 -44.74 46.6 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 N-CA-C 109.093 -0.706 . . . . 1.24 109.093 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.04 -35.37 66.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.531 0.732 . . . . 1.13 112.516 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.54 23.08 27.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.538 -0.839 . . . . 0.61 112.967 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -134.87 -0.28 2.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.8 0.81 . . . . 4.72 110.451 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.587 HG22 HD21 ' A' ' 45' ' ' LEU . 6.3 m -78.5 101.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.268 -1.012 . . . . 1.15 108.268 173.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -89.96 -30.52 17.75 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 114.49 -1.232 . . . . 1.91 110.295 -173.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.425 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.4 p -114.85 130.61 24.01 Favored Pre-proline 0 N--CA 1.403 -2.788 0 CA-C-N 115.085 -0.962 . . . . 1.16 109.914 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.634 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 86.4 Cg_exo -47.91 -46.74 20.85 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.095 3.197 . . . . 0.36 113.738 -175.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.612 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 18.2 ptt180 -54.33 -37.28 64.69 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 114.155 1.169 . . . . 1.84 114.155 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -66.54 -43.56 84.8 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.159 0.504 . . . . 2.13 110.976 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.483 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 3.2 tm? -69.22 -45.07 70.73 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.203 -0.908 . . . . 1.56 109.398 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.6 tp -56.31 -49.79 73.3 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 123.454 0.702 . . . . 1.12 109.411 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -57.23 -46.11 83.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.166 -0.925 . . . . 0.57 111.503 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -61.05 -47.12 87.83 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.241 -0.651 . . . . 2.48 109.241 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 58.3 mt -70.3 -27.98 33.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.795 0.331 . . . . 1.19 111.563 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -39.23 83.91 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 121.922 -0.486 . . . . 1.14 110.032 174.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.51 -39.58 91.09 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.772 -0.931 . . . . 0.53 110.772 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.28 87.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.677 0.275 . . . . 1.22 110.503 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.755 HD21 HG13 ' A' ' 58' ' ' VAL . 4.0 mm? -69.74 -27.57 65.06 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 111.878 0.325 . . . . 1.97 111.878 176.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.51 -33.26 75.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.471 0.653 . . . . 1.26 109.483 174.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -88.74 -57.35 2.94 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.26 -0.882 . . . . 2.44 112.958 -177.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.764 ' HB3' HG12 ' A' ' 58' ' ' VAL . . . -91.86 18.63 7.5 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 114.286 1.217 . . . . 2.12 114.286 -170.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -0.985 0 N-CA-C 108.668 -0.864 . . . . 3.84 108.668 174.453 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 mmt . . . . . 0 C--O 1.242 0.666 0 N-CA-C 112.017 0.377 . . . . 6.86 112.017 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.79 110.73 21.63 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.361 -0.977 . . . . 4.54 108.361 177.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.7 p -79.92 121.86 25.97 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.024 0.44 . . . . 3.27 110.252 -178.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.434 ' HB3' ' OD1' ' A' ' 79' ' ' ASN . 9.1 mp -64.22 160.4 18.64 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.819 0.819 . . . . 1.89 112.218 -179.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.447 HD13 ' CD1' ' A' ' 52' ' ' LEU . 38.6 mt -96.05 142.69 27.95 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.16 -0.927 . . . . 1.38 112.329 -167.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.8 p -101.99 -178.15 3.62 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.451 -1.685 . . . . 1.29 106.451 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.849 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.4 m -59.88 -32.92 71.17 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.315 0.578 . . . . 1.31 110.081 175.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.58 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 15.7 t70 -67.82 -42.76 81.0 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.627 -0.715 . . . . 1.65 110.043 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -63.92 -38.29 90.53 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.55 -0.75 . . . . 1.41 109.476 -179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.4 tp -66.32 -45.68 79.46 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.182 -0.917 . . . . 1.23 109.844 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttp180 -52.41 -46.27 66.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.762 0.425 . . . . 3.04 111.024 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 94.4 mtt180 -54.66 -50.1 69.0 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.531 -0.759 . . . . 4.47 110.187 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.15 87.32 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.402 -0.817 . . . . 1.19 111.841 -175.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.02 -45.74 80.41 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.159 -0.216 . . . . 2.05 110.667 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.3 t -57.09 -40.33 72.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.151 0.5 . . . . 1.33 110.052 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 70.1 mm-40 -60.53 -40.08 90.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.741 -0.663 . . . . 2.05 111.408 177.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -81.29 -34.85 31.72 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 115.492 -0.776 . . . . 1.66 112.162 -174.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.3 -42.93 34.98 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.74 0.305 . . . . 1.58 111.558 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.55 145.26 13.92 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 109.414 -1.474 . . . . 2.32 109.414 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 70.59 147.09 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.191 0.996 . . . . 5.17 110.265 -176.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.9 t -88.48 -176.18 5.22 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 109.168 -0.679 . . . . 5.27 109.168 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.2 t70 50.59 79.0 0.09 Allowed 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.359 1.063 . . . . 4.5 111.199 -174.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.81 96.94 0.97 Allowed Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.236 -0.893 . . . . 3.06 112.183 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.4 p 43.06 -116.55 0.42 Allowed 'General case' 0 C--O 1.244 0.782 0 C-N-CA 125.528 1.531 . . . . 3.17 113.665 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -124.45 26.28 7.36 Favored 'General case' 0 C--N 1.281 -2.406 0 N-CA-C 106.414 -1.699 . . . . 3.23 106.414 177.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.3 tp -81.6 9.27 7.9 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.438 -1.256 . . . . 1.6 110.409 -175.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 p -76.55 138.55 40.26 Favored 'General case' 0 N--CA 1.423 -1.784 0 CA-C-N 115.408 -0.814 . . . . 1.86 110.812 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.74 -139.22 14.42 Favored Glycine 0 N--CA 1.429 -1.823 0 N-CA-C 110.407 -1.077 . . . . 1.11 110.407 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.849 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.4 t70 -105.35 105.36 15.36 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 109.104 -0.702 . . . . 2.07 109.104 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.421 ' HA ' HD21 ' A' ' 33' ' ' LEU . 28.2 p90 -105.4 19.4 20.64 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 116.049 -0.523 . . . . 0.51 111.161 -177.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.838 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 57.9 mt -52.19 -22.9 4.75 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.95 1.463 . . . . 1.12 114.95 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.97 -20.42 19.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.654 0.264 . . . . 2.04 111.513 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' A' ' 30' ' ' PHE . 3.4 mm? -78.48 114.1 17.09 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-O 121.453 0.644 . . . . 2.01 109.587 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.475 ' HG2' HG23 ' A' ' 70' ' ' THR . 40.1 mtt180 -76.35 144.04 40.39 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.718 -1.128 . . . . 4.79 109.978 -172.028 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.611 ' HA ' HG12 ' A' ' 38' ' ' ILE . 44.1 m-85 -61.78 -41.9 98.3 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.369 -0.378 . . . . 0.43 110.993 -174.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -37.5 70.43 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.725 0.774 . . . . 2.79 110.338 176.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -81.09 -23.59 38.32 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.247 -0.888 . . . . 0.88 110.963 -174.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.611 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.2 pt -98.22 15.55 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.408 0.623 . . . . 1.25 111.788 177.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.32 36.9 38.06 Favored Glycine 0 C--O 1.226 -0.377 0 CA-C-N 115.823 -0.626 . . . . 0.66 113.967 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -113.0 127.58 56.27 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 122.305 -0.527 . . . . 1.67 111.356 177.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -86.05 145.37 27.1 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 106.304 -1.739 . . . . 1.06 106.304 172.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.531 ' O ' ' HG3' ' A' ' 46' ' ' MET . 34.1 p -52.55 -31.37 35.5 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 113.275 0.843 . . . . 1.52 113.275 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.69 -43.16 90.09 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.007 0.432 . . . . 2.24 110.108 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.404 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -64.32 -36.38 83.94 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 121.375 0.607 . . . . 1.13 109.392 175.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.575 ' O ' ' HB ' ' A' ' 48' ' ' THR . 50.6 tp -66.39 -40.14 89.49 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.3 -0.863 . . . . 1.15 111.621 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 42' ' ' SER . 60.6 mtt -64.5 -30.19 71.23 Favored 'General case' 0 C--O 1.207 -1.141 0 O-C-N 121.714 -0.616 . . . . 2.13 110.444 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.404 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 7.7 tp10 -61.65 -33.59 74.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 122.282 1.039 . . . . 1.88 108.742 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.575 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 55.8 m -67.92 -61.65 1.77 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.583 -1.644 . . . . 1.18 107.362 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.474 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -54.05 -34.54 60.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.319 -1.309 . . . . 1.02 111.026 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.15 -49.72 73.17 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 123.651 0.78 . . . . 1.12 111.896 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.443 ' HA ' ' OG ' ' A' ' 54' ' ' SER . 92.8 mtt180 -67.3 -30.48 70.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.821 -0.627 . . . . 3.59 111.375 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.526 HD23 ' O ' ' A' ' 48' ' ' THR . 3.9 mm? -64.53 -46.59 82.23 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.47 -0.332 . . . . 1.61 110.198 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.567 ' HA ' HG13 ' A' ' 58' ' ' VAL . 44.4 mt-10 -57.09 -51.38 69.53 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 115.562 -0.745 . . . . 0.48 110.358 177.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.443 ' OG ' ' HA ' ' A' ' 51' ' ' ARG . 6.4 p -63.45 -52.46 61.34 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.501 0.926 . . . . 1.75 113.501 -178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.478 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 30.3 ttm180 -66.46 -49.84 65.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.809 0.67 . . . . 3.52 112.809 -177.096 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.478 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 99.6 m-85 -92.56 -17.36 24.53 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.056 0.762 . . . . 1.35 113.056 -170.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.15 68.14 1.44 Allowed Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.243 -0.979 . . . . 0.93 110.945 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.567 HG13 ' HA ' ' A' ' 53' ' ' GLU . 10.8 p -141.61 176.1 4.64 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 N-CA-C 108.066 -1.087 . . . . 1.72 108.066 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.468 ' H ' HG22 ' A' ' 58' ' ' VAL . 4.4 p -140.68 107.36 5.35 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.345 0.593 . . . . 2.39 109.996 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.451 HD11 ' HB2' ' A' ' 49' ' ' ALA . 61.6 mt -105.99 111.81 64.38 Favored Pre-proline 0 C--N 1.31 -1.109 0 CA-C-N 115.227 -0.897 . . . . 1.21 109.197 -176.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -59.58 130.13 34.06 Favored 'Trans proline' 0 C--O 1.25 1.076 0 C-N-CA 122.629 2.22 . . . . 1.09 111.515 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -51.18 -39.46 56.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.306 1.442 . . . . 1.83 111.961 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.42 -39.02 85.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.496 -0.32 . . . . 2.34 111.292 -177.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.22 -39.54 42.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 109.041 -0.726 . . . . 1.24 109.041 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -36.69 73.88 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.904 -0.589 . . . . 1.13 111.096 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -88.65 4.83 85.08 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.015 -0.612 . . . . 0.61 112.349 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -102.78 -25.21 13.6 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 122.779 -0.248 . . . . 4.72 111.271 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 m -72.71 105.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.835 0.826 . . . . 1.15 109.933 -178.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.435 ' OD2' ' HD3' ' A' ' 34' ' ' ARG . 34.1 t70 -87.44 -24.28 24.21 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 114.722 -1.126 . . . . 1.91 110.807 -176.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.475 HG23 ' HG2' ' A' ' 34' ' ' ARG . 31.9 p -123.96 138.93 31.44 Favored Pre-proline 0 N--CA 1.418 -2.053 0 CA-C-N 115.685 -0.689 . . . . 1.16 110.705 -178.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.838 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.2 Cg_exo -54.73 -34.16 83.23 Favored 'Trans proline' 0 CA--C 1.514 -0.509 0 C-N-CA 123.669 2.913 . . . . 0.36 112.812 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -51.8 -45.21 63.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 123.413 0.446 . . . . 1.84 111.966 175.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.38 -45.32 88.19 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 121.29 0.567 . . . . 2.13 110.483 178.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.05 -46.2 75.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.328 -0.851 . . . . 1.56 109.88 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.42 -46.08 83.93 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 116.216 -0.447 . . . . 1.12 109.803 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.11 -43.34 98.7 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.189 -0.914 . . . . 0.57 110.546 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.58 -52.28 66.08 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 123.568 0.747 . . . . 2.48 111.301 -177.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.7 mt -68.2 -46.62 80.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.558 0 C-N-CA 120.234 -0.586 . . . . 1.19 110.62 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.434 ' OD1' ' HB3' ' A' ' 4' ' ' LEU . 17.1 m-80 -55.99 -42.54 76.51 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 120.61 0.243 . . . . 1.14 110.575 177.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.12 -46.38 65.69 Favored Glycine 0 C--N 1.321 -0.304 0 CA-C-N 116.303 -0.408 . . . . 0.53 112.624 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.24 -35.91 80.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.705 0.288 . . . . 1.22 110.565 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.06 -39.45 79.12 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.376 -0.374 . . . . 1.97 111.138 176.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.55 -42.52 98.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.233 -0.44 . . . . 1.26 110.669 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -84.84 13.61 5.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.998 0.74 . . . . 2.44 112.998 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.07 73.42 6.36 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 107.975 -1.121 . . . . 2.12 107.975 173.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.587 0 CA-C-N 115.37 -0.832 . . . . 3.84 110.089 -176.529 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mtp . . . . . 0 CA--C 1.512 -0.483 0 N-CA-C 109.827 -0.435 . . . . 6.86 109.827 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.79 157.69 37.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.146 -0.686 . . . . 4.54 109.146 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 13.0 p -71.25 106.64 3.89 Favored 'General case' 0 CA--C 1.491 -1.325 0 CA-C-O 122.24 1.019 . . . . 3.27 109.175 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.424 HD11 ' HA ' ' A' ' 79' ' ' ASN . 25.7 tp -70.07 161.66 29.71 Favored 'General case' 0 N--CA 1.398 -3.031 0 CA-C-N 112.892 -1.958 . . . . 1.89 109.805 -174.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.7 mt -92.52 128.48 38.39 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-N 115.855 -0.611 . . . . 1.38 111.051 -176.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.6 p -97.8 -176.35 3.44 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.409 -1.7 . . . . 1.29 106.409 168.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.4 m -57.81 -36.19 71.88 Favored 'General case' 0 C--N 1.312 -1.022 0 O-C-N 123.039 0.212 . . . . 1.31 110.626 174.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.509 ' O ' ' HB3' ' A' ' 11' ' ' ARG . 25.6 t70 -78.53 -32.71 48.09 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.076 0.465 . . . . 1.65 111.069 -177.301 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.46 -42.78 87.07 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.97 -0.752 . . . . 1.41 108.97 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.681 HD11 HD21 ' A' ' 74' ' ' LEU . 13.9 tp -66.54 -41.69 88.34 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.729 -1.123 . . . . 1.23 108.667 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.509 ' HB3' ' O ' ' A' ' 8' ' ' ASP . 72.6 ttt180 -48.32 -58.48 4.53 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.203 1.401 . . . . 3.04 111.601 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.519 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 62.3 mtp180 -58.18 -36.44 73.06 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 112.498 0.555 . . . . 4.47 112.498 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -45.2 95.3 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 123.377 0.423 . . . . 1.19 109.905 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.93 -42.36 90.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.344 -0.389 . . . . 2.05 111.799 177.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.416 HG21 ' O ' ' A' ' 11' ' ' ARG . 90.6 t -54.54 -51.71 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 121.029 0.442 . . . . 1.33 110.221 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.599 ' HA ' HG22 ' A' ' 21' ' ' THR . 13.7 mm-40 -63.72 -32.61 74.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.505 -0.77 . . . . 2.05 112.522 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -94.37 -2.86 51.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.745 0.646 . . . . 1.66 112.745 -175.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.21 -25.55 66.97 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.982 0.42 . . . . 1.58 110.91 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 137.57 -83.9 0.25 Allowed Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 120.767 -0.73 . . . . 2.32 112.259 177.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -95.11 24.29 5.03 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.189 0.596 . . . . 5.17 109.767 -175.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.599 HG22 ' HA ' ' A' ' 16' ' ' GLU . 59.2 p 52.24 49.49 20.44 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 123.402 1.573 . . . . 5.27 109.132 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -47.63 -57.3 5.65 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 111.086 -2.779 . . . . 4.5 111.617 -174.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.34 61.58 1.46 Allowed Glycine 0 N--CA 1.432 -1.606 0 C-N-CA 120.113 -1.042 . . . . 3.06 111.237 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.4 154.04 36.81 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 123.07 0.548 . . . . 3.17 109.877 177.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.84 82.36 2.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.881 1.324 . . . . 3.23 112.22 -175.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.64 ' HG ' ' CD2' ' A' ' 30' ' ' PHE . 6.0 mp -109.45 30.87 6.22 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 125.894 1.678 . . . . 1.6 108.053 -178.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.0 m -65.73 100.09 0.51 Allowed 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.593 -1.185 . . . . 1.86 113.704 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.88 -69.29 3.1 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.74 -0.663 . . . . 1.11 113.631 174.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -137.56 119.21 15.01 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.925 -0.398 . . . . 2.07 109.925 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.64 ' CD2' ' HG ' ' A' ' 26' ' ' LEU . 14.0 p90 -136.4 15.16 3.21 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.261 0.553 . . . . 0.51 110.075 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.62 HD22 ' HB2' ' A' ' 71' ' ' PRO . 60.1 mt -53.48 -24.16 12.25 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.183 1.549 . . . . 1.12 115.183 -177.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -95.36 -3.34 47.35 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.387 0.514 . . . . 2.04 112.387 -178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.468 ' O ' ' HD3' ' A' ' 71' ' ' PRO . 8.9 mp -80.63 138.81 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.394 -0.367 . . . . 2.01 110.698 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.11 141.37 35.83 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 109.785 -0.45 . . . . 4.79 109.785 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.452 ' HA ' HG12 ' A' ' 38' ' ' ILE . 50.4 m-85 -68.27 -42.91 78.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.362 0.601 . . . . 0.43 109.468 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.454 ' CD ' ' H ' ' A' ' 36' ' ' GLU . 1.5 mp0 -54.67 -34.96 63.04 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 124.655 1.182 . . . . 2.79 109.921 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -79.32 -31.39 43.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.564 -1.198 . . . . 0.88 111.124 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.533 HG13 ' CD1' ' A' ' 40' ' ' TYR . 31.0 pt -93.21 15.78 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 120.485 -0.486 . . . . 1.25 111.572 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.19 34.36 17.76 Favored Glycine 0 C--O 1.238 0.382 0 CA-C-N 115.732 -0.667 . . . . 0.66 114.127 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.533 ' CD1' HG13 ' A' ' 38' ' ' ILE . 9.1 m-85 -116.45 123.16 46.82 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 122.598 -0.354 . . . . 1.67 111.264 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.09 151.16 24.35 Favored 'General case' 0 CA--C 1.48 -1.726 0 N-CA-C 106.439 -1.689 . . . . 1.06 106.439 171.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.3 p -53.51 -34.63 58.81 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 113.076 0.769 . . . . 1.52 113.076 179.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.71 -45.95 77.1 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 109.307 -0.627 . . . . 2.24 109.307 177.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.78 94.9 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.474 0.654 . . . . 1.13 109.846 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.592 HD22 HG22 ' A' ' 68' ' ' VAL . 56.7 tp -62.19 -40.16 95.15 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.686 -1.143 . . . . 1.15 110.175 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 81.9 mtp -63.99 -33.15 75.09 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.213 -0.449 . . . . 2.13 111.489 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.91 -29.3 70.23 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.492 0.663 . . . . 1.88 109.995 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.412 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 24.7 m -64.8 -61.86 1.92 Allowed 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.912 -1.514 . . . . 1.18 106.912 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.2 -36.06 70.39 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.776 -1.556 . . . . 1.02 110.655 177.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.5 -45.9 87.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.19 0.596 . . . . 1.12 111.96 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.53 -37.52 86.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.852 -0.613 . . . . 3.59 110.222 177.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 96.7 mt -64.38 -43.08 95.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.194 -0.457 . . . . 1.61 110.667 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 40.4 mt-10 -57.0 -54.05 51.16 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 109.936 -0.394 . . . . 0.48 109.936 175.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.4 m -61.55 -39.7 92.05 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.912 -1.04 . . . . 1.75 111.783 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.495 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 32.1 ttm180 -67.53 -50.55 58.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.27 -0.423 . . . . 3.52 111.733 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.495 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 89.9 m-85 -96.92 -22.91 16.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.691 1.367 . . . . 1.35 114.691 -171.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.63 21.66 33.58 Favored Glycine 0 C--N 1.306 -1.113 0 C-N-CA 119.937 -1.125 . . . . 0.93 112.461 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.02 137.41 26.55 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 N-CA-C 108.645 -0.872 . . . . 1.72 108.645 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.0 m -98.34 113.23 25.13 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.044 0.449 . . . . 2.39 110.866 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.6 mt -99.35 125.24 41.94 Favored Pre-proline 0 C--N 1.31 -1.125 0 CA-C-N 116.251 -0.432 . . . . 1.21 110.026 -178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -62.77 116.01 3.28 Favored 'Trans proline' 0 C--O 1.243 0.74 0 C-N-CA 122.2 1.933 . . . . 1.09 110.044 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -55.24 -24.25 26.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.92 0.888 . . . . 1.83 113.059 -177.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.84 -43.94 74.47 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.175 0.512 . . . . 2.34 110.007 176.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 32.6 t -74.55 -34.71 36.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 109.142 -0.688 . . . . 1.24 109.142 -177.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.7 -24.5 61.52 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.726 -0.67 . . . . 1.13 111.976 178.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -0.11 48.36 Favored Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.548 -0.834 . . . . 0.61 112.449 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -100.62 -12.81 18.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.184 0.516 . . . . 4.72 110.606 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.592 HG22 HD22 ' A' ' 45' ' ' LEU . 19.0 m -74.04 115.96 15.84 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.296 0 CA-C-O 121.635 0.731 . . . . 1.15 110.576 -177.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.98 -49.85 6.53 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 114.637 -1.165 . . . . 1.91 109.701 -176.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.522 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 26.5 p -118.15 157.31 49.18 Favored Pre-proline 0 N--CA 1.406 -2.671 0 CA-C-N 114.775 -1.102 . . . . 1.16 109.314 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.62 ' HB2' HD22 ' A' ' 31' ' ' LEU . 49.2 Cg_exo -58.49 -27.28 81.59 Favored 'Trans proline' 0 CA--C 1.5 -1.202 0 C-N-CA 123.591 2.861 . . . . 0.36 112.657 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -52.97 -48.64 67.27 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.602 0.564 . . . . 1.84 110.002 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.68 -47.61 80.53 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 114.626 -1.17 . . . . 2.13 109.828 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.681 HD21 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -67.19 -50.27 61.6 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.853 -1.067 . . . . 1.56 110.144 -175.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 79' ' ' ASN . 59.7 tp -55.85 -52.1 65.2 Favored 'General case' 0 C--O 1.206 -1.198 0 O-C-N 123.61 0.569 . . . . 1.12 110.389 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.04 -37.3 82.13 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 123.69 0.619 . . . . 0.57 112.03 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.98 -52.27 64.68 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.314 -0.403 . . . . 2.48 109.945 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.7 mt -70.67 -44.49 76.51 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.902 0 C-N-CA 120.223 -0.591 . . . . 1.19 109.932 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 75' ' ' LEU . 6.7 t-20 -49.52 -53.59 22.62 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 123.735 0.814 . . . . 1.14 110.755 -175.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.84 94.67 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.985 -0.626 . . . . 0.53 112.696 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.72 -33.94 73.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.12 0.486 . . . . 1.22 111.607 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 26.3 tp -78.68 -31.91 46.86 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 123.835 0.854 . . . . 1.97 110.051 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.02 96.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.569 0.7 . . . . 1.26 109.764 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.81 8.28 20.6 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.318 -0.856 . . . . 2.44 111.679 -178.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.66 116.48 24.8 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.599 -0.519 . . . . 2.12 109.599 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.295 -1.776 0 N-CA-C 107.386 -1.338 . . . . 3.84 107.386 179.12 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.1 mmm . . . . . 0 CA--C 1.51 -0.564 0 N-CA-C 108.945 -0.761 . . . . 6.86 108.945 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.06 -176.49 5.97 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 107.487 -1.301 . . . . 4.54 107.487 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -72.13 106.46 4.37 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 122.624 1.202 . . . . 3.27 109.591 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.461 HD11 ' HA ' ' A' ' 79' ' ' ASN . 46.4 tp -130.56 166.92 19.58 Favored 'General case' 0 N--CA 1.402 -2.848 0 CA-C-N 113.471 -1.695 . . . . 1.89 107.326 -175.314 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.0 mt -84.11 122.45 28.83 Favored 'General case' 0 C--N 1.289 -2.056 0 C-N-CA 120.422 -0.511 . . . . 1.38 109.8 179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.4 p -102.1 -173.92 2.45 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.239 -1.393 . . . . 1.29 107.239 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.9 m -58.36 -43.3 88.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.75 -0.833 . . . . 1.31 108.75 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.9 -47.1 87.96 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.76 -1.109 . . . . 1.65 110.943 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.27 -39.02 89.14 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 116.091 -0.504 . . . . 1.41 110.771 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.437 HD12 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -66.03 -41.59 90.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 1.23 110.02 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -53.31 -54.73 32.19 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.878 0.871 . . . . 3.04 109.634 175.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -58.72 -38.85 79.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.491 -1.231 . . . . 4.47 111.42 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.96 82.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.08 -0.509 . . . . 1.19 111.536 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.614 HD21 HG22 ' A' ' 48' ' ' THR . 94.8 mt -63.67 -44.58 93.32 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.219 0.533 . . . . 2.05 109.97 178.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.0 t -62.77 -50.62 79.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.395 -0.82 . . . . 1.33 109.103 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -59.72 -25.05 64.5 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 2.05 113.167 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.617 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 27.5 m -90.52 -29.99 17.55 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.81 0.338 . . . . 1.66 111.721 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.48 -32.06 54.06 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.667 -0.864 . . . . 1.58 108.667 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.88 -63.54 0.34 Allowed Glycine 0 CA--C 1.481 -2.093 0 N-CA-C 107.766 -2.134 . . . . 2.32 107.766 -177.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -157.75 148.29 20.85 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 106.487 -1.671 . . . . 5.17 106.487 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -155.49 -161.53 1.19 Allowed 'General case' 0 C--N 1.29 -2.008 0 N-CA-C 109.514 -0.55 . . . . 5.27 109.514 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.12 -53.05 3.78 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.953 -0.758 . . . . 4.5 108.953 178.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.25 44.26 6.31 Favored Glycine 0 N--CA 1.432 -1.618 0 N-CA-C 109.448 -1.461 . . . . 3.06 109.448 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 t -52.05 93.07 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.266 1.426 . . . . 3.17 113.209 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 63.51 25.54 14.47 Favored 'General case' 0 CA--C 1.501 -0.924 0 C-N-CA 124.19 0.996 . . . . 3.23 110.737 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 9.7 tp -76.78 -25.48 53.4 Favored 'General case' 0 C--O 1.248 0.987 0 CA-C-N 114.854 -1.066 . . . . 1.6 108.293 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.2 m -67.57 135.68 53.31 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.509 -1.223 . . . . 1.86 108.581 176.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.83 -131.85 10.75 Favored Glycine 0 N--CA 1.435 -1.377 0 N-CA-C 110.671 -0.972 . . . . 1.11 110.671 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -120.06 104.98 10.58 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.85 -0.796 . . . . 2.07 108.85 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -108.96 12.55 25.26 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 120.198 -0.601 . . . . 0.51 110.734 -178.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.554 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 57.2 mt -51.45 -28.63 13.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.834 1.79 . . . . 1.12 115.834 -176.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -96.73 -6.79 35.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.489 0.661 . . . . 2.04 111.534 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 8.9 mp -79.82 129.68 34.69 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 121.875 -0.516 . . . . 2.01 110.122 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.76 137.78 39.51 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 109.455 -0.572 . . . . 4.79 109.455 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -58.54 -49.72 76.38 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 123.69 0.619 . . . . 0.43 110.23 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -57.28 -27.37 62.06 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.466 0.479 . . . . 2.79 111.697 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -81.74 -32.22 31.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.752 0.31 . . . . 0.88 110.315 -176.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.5 pt -93.72 23.18 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 112.224 0.453 . . . . 1.25 112.224 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 78.44 14.88 81.69 Favored Glycine 0 C--O 1.24 0.507 0 C-N-CA 121.118 -0.563 . . . . 0.66 113.855 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -103.36 125.77 50.16 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.007 0.432 . . . . 1.67 111.097 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -87.46 138.48 31.44 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 108.195 -1.039 . . . . 1.06 108.195 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.3 p -51.4 -33.09 28.74 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 123.718 0.636 . . . . 1.52 112.33 173.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.692 ' HA ' ' HE2' ' A' ' 46' ' ' MET . 7.2 tt -65.77 -48.66 71.07 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.199 -0.667 . . . . 2.24 109.199 177.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.21 -34.09 76.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.464 0.649 . . . . 1.13 109.949 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.448 ' O ' ' HB ' ' A' ' 48' ' ' THR . 64.2 tp -63.13 -33.49 75.57 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.0 -1.0 . . . . 1.15 111.188 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.692 ' HE2' ' HA ' ' A' ' 43' ' ' LEU . 69.9 mtm -64.24 -33.81 76.66 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.413 -0.515 . . . . 2.13 110.775 176.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.08 -34.05 77.49 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-O 121.631 0.729 . . . . 1.88 109.556 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.617 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 37.2 m -66.21 -57.51 7.43 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.843 -1.169 . . . . 1.18 107.843 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.527 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.5 -36.17 66.38 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 113.963 -1.471 . . . . 1.02 109.595 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.16 -44.4 87.9 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 123.085 0.554 . . . . 1.12 112.279 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 38.0 mtp180 -66.19 -34.24 77.59 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.382 0.611 . . . . 3.59 109.975 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 49' ' ' ALA . 94.5 mt -65.71 -44.9 84.7 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.575 -0.739 . . . . 1.61 109.977 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.601 ' HA ' HG11 ' A' ' 58' ' ' VAL . 47.2 mt-10 -58.1 -44.17 87.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.48 109.927 174.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -61.3 -59.63 5.0 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.496 -1.229 . . . . 1.75 110.817 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -66.12 -41.94 89.83 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.77 1.026 . . . . 3.52 113.77 -177.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -95.26 -17.88 21.32 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.97 1.1 . . . . 1.35 113.97 -172.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.21 65.79 1.89 Allowed Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.012 -1.09 . . . . 0.93 110.858 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.601 HG11 ' HA ' ' A' ' 53' ' ' GLU . 10.6 p -140.63 176.18 5.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 107.969 -1.123 . . . . 1.72 107.969 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.464 ' H ' HG21 ' A' ' 58' ' ' VAL . 22.2 p -140.96 105.47 4.87 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.594 0.711 . . . . 2.39 110.01 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.7 mt -96.9 122.5 56.47 Favored Pre-proline 0 C--N 1.291 -1.955 0 CA-C-N 115.738 -0.664 . . . . 1.21 109.543 -174.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.89 128.47 26.87 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.715 2.277 . . . . 1.09 111.531 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -52.97 -37.78 61.5 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.777 1.231 . . . . 1.83 111.435 -178.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.54 -40.98 85.02 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 115.088 -0.96 . . . . 2.34 110.492 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.7 HG12 ' HG ' ' A' ' 77' ' ' LEU . 61.4 t -74.54 -45.05 46.54 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.221 -0.659 . . . . 1.24 109.221 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.23 -36.89 66.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 1.13 111.861 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.73 22.66 34.92 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.302 -0.952 . . . . 0.61 112.782 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -135.03 4.66 3.26 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.821 0.82 . . . . 4.72 110.162 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 m -82.01 124.08 38.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.009 -0.737 . . . . 1.15 109.009 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.37 -40.09 13.82 Favored 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 120.993 -0.283 . . . . 1.91 111.641 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 33.3 p -119.55 151.32 51.54 Favored Pre-proline 0 N--CA 1.417 -2.085 0 O-C-N 123.324 0.39 . . . . 1.16 110.672 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.554 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 68.6 Cg_exo -55.38 -32.24 80.8 Favored 'Trans proline' 0 C--O 1.206 -1.079 0 C-N-CA 123.657 2.905 . . . . 0.36 112.097 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.0 ttm105 -52.28 -48.26 65.41 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.769 0.668 . . . . 1.84 110.154 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -63.78 -48.9 75.09 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.95 0.9 . . . . 2.13 110.949 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.437 HD12 HD12 ' A' ' 10' ' ' LEU . 3.3 tm? -66.48 -44.95 81.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.023 -0.99 . . . . 1.56 110.407 -176.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.7 tp -57.78 -47.22 83.18 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.135 0.574 . . . . 1.12 109.974 178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.2 -47.71 80.58 Favored 'General case' 0 CA--C 1.506 -0.734 0 O-C-N 123.822 0.701 . . . . 0.57 111.689 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.7 ' HG ' HG12 ' A' ' 64' ' ' VAL . 3.4 tm? -59.66 -48.89 79.88 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 124.011 0.82 . . . . 2.48 109.872 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.9 mt -69.24 -39.22 78.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 116.164 -0.471 . . . . 1.19 110.541 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.461 ' HA ' HD11 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -60.65 -43.46 97.58 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.917 -0.129 . . . . 1.14 111.098 177.492 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.79 -42.59 98.47 Favored Glycine 0 N--CA 1.448 -0.531 0 O-C-N 123.481 0.488 . . . . 0.53 111.924 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.88 -42.9 72.85 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.072 0.463 . . . . 1.22 110.716 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.14 -14.61 62.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.881 0.697 . . . . 1.97 112.881 179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.84 67.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.468 0.652 . . . . 1.26 109.686 173.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -91.07 4.45 52.11 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-N 115.828 -0.624 . . . . 2.44 110.757 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -95.34 142.86 27.24 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.613 -0.514 . . . . 2.12 109.613 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.623 0 N-CA-C 108.818 -0.808 . . . . 3.84 108.818 -178.783 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.5 mtm . . . . . 0 CA--C 1.503 -0.846 0 N-CA-C 109.057 -0.72 . . . . 6.86 109.057 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.15 24.58 2.13 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.642 -0.503 . . . . 4.54 109.642 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.763 ' HA ' ' HE1' ' A' ' 56' ' ' TYR . 8.5 t -122.53 103.67 8.85 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.265 1.031 . . . . 3.27 111.157 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.536 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 30.1 tp 156.55 160.37 0.01 OUTLIER 'General case' 0 N--CA 1.419 -1.995 0 C-N-CA 128.321 2.649 . . . . 1.89 105.059 172.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.536 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 88.5 mt -122.86 123.03 40.08 Favored 'General case' 0 C--N 1.284 -2.243 0 N-CA-C 108.251 -1.018 . . . . 1.38 108.251 173.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.0 p -101.54 -170.47 1.83 Allowed 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 107.841 -1.17 . . . . 1.29 107.841 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.527 HG23 ' HA ' ' A' ' 29' ' ' ASP . 3.3 m -54.58 -54.57 39.62 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 123.294 0.638 . . . . 1.31 111.407 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -73.08 -28.47 62.31 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.703 -0.399 . . . . 1.65 111.805 -176.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.88 -38.56 86.53 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 108.636 -0.875 . . . . 1.41 108.636 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.527 HD23 ' HB2' ' A' ' 75' ' ' LEU . 14.2 tp -66.48 -45.62 79.04 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.225 -0.898 . . . . 1.23 108.671 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.538 ' O ' HG21 ' A' ' 15' ' ' VAL . 2.5 tmt_? -50.62 -51.43 48.8 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.12 0.968 . . . . 3.04 109.709 175.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -57.72 -42.25 83.43 Favored 'General case' 0 C--N 1.313 -1.013 0 C-N-CA 124.824 1.249 . . . . 4.47 110.883 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.84 99.91 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 115.467 -0.788 . . . . 1.19 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.599 HD12 HG22 ' A' ' 48' ' ' THR . 11.1 mp -63.79 -41.64 97.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.98 -0.554 . . . . 2.05 111.133 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.538 HG21 ' O ' ' A' ' 11' ' ' ARG . 66.8 t -56.35 -55.98 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.526 -0.546 . . . . 1.33 109.526 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -54.91 -49.11 72.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.517 -0.765 . . . . 2.05 111.968 -178.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.479 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 4.0 m -77.28 -9.33 58.75 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.27 0.47 . . . . 1.66 112.27 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -98.64 -1.63 40.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.029 0.442 . . . . 1.58 110.781 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.65 17.71 57.92 Favored Glycine 0 C--N 1.317 -0.527 0 C-N-CA 119.994 -1.098 . . . . 2.32 111.303 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.431 ' HG2' HG12 ' A' ' 15' ' ' VAL . 39.4 mt-10 60.18 67.56 0.84 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.675 1.19 . . . . 5.17 112.675 177.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.52 -148.78 0.14 Allowed 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 108.989 -0.745 . . . . 5.27 108.989 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -92.93 -35.42 13.33 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.33 -0.856 . . . . 4.5 109.104 177.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.52 4.93 65.49 Favored Glycine 0 C--O 1.219 -0.801 0 CA-C-O 119.11 -0.828 . . . . 3.06 113.959 175.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.3 t 46.48 51.04 12.19 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.568 1.147 . . . . 3.17 111.305 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 60.57 80.19 0.22 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 113.951 -1.477 . . . . 3.23 110.087 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.7 tp -107.79 -23.21 12.17 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 113.869 -1.514 . . . . 1.6 109.781 -173.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.5 m -59.0 125.11 22.27 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.429 -0.805 . . . . 1.86 112.521 -174.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.38 -139.89 14.74 Favored Glycine 0 N--CA 1.43 -1.712 0 CA-C-N 115.899 -0.591 . . . . 1.11 112.649 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.527 ' HA ' HG23 ' A' ' 7' ' ' THR . 16.3 t70 -85.45 102.52 13.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.15 0.5 . . . . 2.07 110.251 -178.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -115.82 13.29 16.07 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.857 -0.61 . . . . 0.51 109.683 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.767 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 48.6 mt -51.66 -21.68 2.84 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.687 1.736 . . . . 1.12 115.687 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -90.74 -21.63 21.47 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.181 0.515 . . . . 2.04 111.531 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mp -77.86 117.92 19.68 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 116.079 -0.51 . . . . 2.01 110.084 -175.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -71.92 144.84 48.82 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.648 -0.871 . . . . 4.79 108.648 -176.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.49 ' HA ' HG12 ' A' ' 38' ' ' ILE . 66.9 m-85 -57.26 -45.69 83.76 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.37 0.508 . . . . 0.43 112.37 -175.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.8 -31.19 70.58 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.712 0.767 . . . . 2.79 111.37 178.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -81.54 -17.82 47.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.242 -0.89 . . . . 0.88 109.939 -175.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.49 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.1 pt -101.8 14.47 5.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.381 0.61 . . . . 1.25 111.622 173.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.4 18.71 77.62 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.636 -0.711 . . . . 0.66 114.153 175.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -98.84 128.15 44.97 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 122.422 -0.457 . . . . 1.67 111.788 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -88.72 151.05 22.66 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.991 -1.114 . . . . 1.06 107.991 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.553 ' O ' ' HG3' ' A' ' 46' ' ' MET . 60.7 p -53.99 -28.38 37.51 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.456 0.539 . . . . 1.52 112.456 175.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.63 -58.6 6.95 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.365 -0.606 . . . . 2.24 109.365 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.095 0.474 . . . . 1.13 110.577 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.488 ' O ' ' HB ' ' A' ' 48' ' ' THR . 57.6 tp -62.54 -45.18 94.14 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.523 -0.762 . . . . 1.15 110.818 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.553 ' HG3' ' O ' ' A' ' 42' ' ' SER . 61.7 mtt -63.65 -40.71 97.55 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.6 0.238 . . . . 2.13 110.544 177.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.07 -29.02 70.19 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.767 0.794 . . . . 1.88 111.055 177.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.599 HG22 HD12 ' A' ' 14' ' ' LEU . 92.3 m -65.91 -54.8 21.71 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.152 -1.425 . . . . 1.18 107.152 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.495 ' HA ' HD13 ' A' ' 52' ' ' LEU . . . -57.6 -33.79 68.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.816 -1.538 . . . . 1.02 110.73 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -57.33 -46.99 82.72 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.408 0.683 . . . . 1.12 112.275 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 47.3 mtp180 -64.63 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.369 0.604 . . . . 3.59 109.782 178.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 49' ' ' ALA . 83.0 mt -66.67 -43.25 85.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.416 -0.811 . . . . 1.61 110.221 177.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.5 mt-10 -55.18 -53.74 52.12 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.175 -0.676 . . . . 0.48 109.175 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -62.64 -42.54 99.66 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.062 -0.972 . . . . 1.75 112.609 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.06 -42.71 93.95 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.488 0.551 . . . . 3.52 112.488 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.763 ' HE1' ' HA ' ' A' ' 3' ' ' THR . 69.3 m-85 -96.4 -0.23 49.59 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 113.932 1.086 . . . . 1.35 113.932 -173.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 67.64 48.27 57.27 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 111.241 -0.744 . . . . 0.93 111.241 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG23 ' H ' ' A' ' 59' ' ' SER . 12.7 p -139.01 176.01 6.92 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 N-CA-C 107.612 -1.255 . . . . 1.72 107.612 -177.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.412 ' H ' HG23 ' A' ' 58' ' ' VAL . 16.2 t -142.17 143.41 32.95 Favored 'General case' 0 N--CA 1.421 -1.905 0 N-CA-C 108.808 -0.812 . . . . 2.39 108.808 175.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.478 HD12 ' HB3' ' A' ' 49' ' ' ALA . 64.6 mt -121.82 123.39 27.43 Favored Pre-proline 0 C--N 1.296 -1.735 0 N-CA-C 107.417 -1.327 . . . . 1.21 107.417 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.07 138.91 81.31 Favored 'Trans proline' 0 C--O 1.254 1.278 0 C-N-CA 122.356 2.038 . . . . 1.09 111.158 177.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -53.54 -38.69 64.04 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.877 0.871 . . . . 1.83 111.296 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.53 -33.88 75.96 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.407 -0.361 . . . . 2.34 111.247 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 81.2 t -73.1 -50.17 33.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 N-CA-C 108.083 -1.081 . . . . 1.24 108.083 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.62 -26.35 61.44 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.198 -0.91 . . . . 1.13 112.396 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.89 0.98 51.81 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.615 -0.802 . . . . 0.61 113.635 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -98.63 -16.3 19.12 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 117.779 0.789 . . . . 4.72 110.631 -178.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.515 HG21 HD21 ' A' ' 74' ' ' LEU . 23.1 m -74.41 113.44 12.86 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-N 115.508 -0.769 . . . . 1.15 109.81 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -89.66 -39.03 13.47 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-N 115.553 -0.748 . . . . 1.91 111.801 -177.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 37.3 p -115.65 150.77 45.33 Favored Pre-proline 0 N--CA 1.416 -2.134 0 CA-C-N 115.675 -0.693 . . . . 1.16 109.969 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.767 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.2 Cg_exo -53.99 -40.45 81.03 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.623 2.882 . . . . 0.36 114.502 -178.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -36.48 64.13 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.698 0.681 . . . . 1.84 111.677 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -62.6 -53.54 53.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.274 -0.639 . . . . 2.13 109.274 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.515 HD21 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -65.38 -46.43 80.12 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 1.56 110.051 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.527 ' HB2' HD23 ' A' ' 10' ' ' LEU . 43.4 tp -58.17 -52.82 63.97 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.077 -0.51 . . . . 1.12 111.064 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.93 -39.37 93.4 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.012 0.375 . . . . 0.57 112.012 -176.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.21 -42.54 99.4 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.645 0.26 . . . . 2.48 111.236 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.574 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.26 -43.23 65.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 110.022 -0.362 . . . . 1.19 110.022 178.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -52.61 -47.23 67.1 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.713 0.405 . . . . 1.14 111.328 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.31 -44.19 96.73 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.628 -0.589 . . . . 0.53 111.628 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.95 74.78 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 122.814 0.446 . . . . 1.22 111.07 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 78.6 mt -67.74 -39.36 84.25 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 122.754 0.422 . . . . 1.97 110.352 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.81 -31.62 72.93 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.755 -0.657 . . . . 1.26 110.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -75.91 -37.85 58.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.999 -0.546 . . . . 2.44 110.806 176.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.93 -51.62 37.99 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.918 -0.583 . . . . 2.12 111.477 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.422 0 CA-C-O 119.176 -0.44 . . . . 3.84 109.845 -177.975 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 C--O 1.24 0.563 0 CA-C-O 120.564 0.221 . . . . 6.86 110.678 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.06 79.45 5.18 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.685 0.755 . . . . 4.54 110.851 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 36.2 m -103.53 117.72 35.09 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 114.828 -1.078 . . . . 3.27 109.726 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.584 HD13 ' HB3' ' A' ' 82' ' ' LEU . 10.1 mp -79.42 154.89 28.62 Favored 'General case' 0 CA--C 1.486 -1.512 0 CA-C-O 121.538 0.685 . . . . 1.89 110.792 177.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.466 HD11 HD21 ' A' ' 52' ' ' LEU . 38.9 mt -89.56 126.37 35.58 Favored 'General case' 0 C--N 1.273 -2.723 0 CA-C-N 114.385 -1.28 . . . . 1.38 109.873 -173.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.5 p -99.42 -170.13 1.86 Allowed 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 107.06 -1.459 . . . . 1.29 107.06 169.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 m -52.37 -54.21 34.81 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 118.399 0.545 . . . . 1.31 111.385 -178.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -64.43 -41.81 96.37 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 116.163 -0.471 . . . . 1.65 111.71 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -65.47 -43.5 90.07 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 121.185 0.517 . . . . 1.41 110.046 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.726 HD12 HD22 ' A' ' 74' ' ' LEU . 40.9 tp -65.58 -44.4 86.81 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.393 -0.821 . . . . 1.23 109.776 -178.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.47 ' O ' HG21 ' A' ' 15' ' ' VAL . 36.9 ttm105 -52.29 -44.4 65.0 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.709 0.631 . . . . 3.04 110.93 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.577 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 75.9 ttt180 -56.37 -40.05 73.94 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.531 0.519 . . . . 4.47 111.192 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.31 -37.48 85.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.711 0.291 . . . . 1.19 110.524 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.547 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.53 -34.28 77.56 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.192 -0.458 . . . . 2.05 110.28 175.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 11' ' ' ARG . 28.3 t -73.13 -29.79 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.415 0.626 . . . . 1.33 109.826 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 22.2 mm-40 -61.16 -53.11 61.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.457 -0.792 . . . . 2.05 110.168 177.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.801 ' HG ' ' HH ' ' A' ' 40' ' ' TYR . 4.9 p -75.76 -32.38 59.93 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.061 0.393 . . . . 1.66 112.061 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.57 26.7 1.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.363 0.601 . . . . 1.58 110.164 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.22 -8.52 47.07 Favored Glycine 0 N--CA 1.429 -1.821 0 N-CA-C 109.979 -1.248 . . . . 2.32 109.979 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -117.28 89.28 3.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.237 -1.023 . . . . 5.17 108.237 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.1 m 72.2 123.27 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.972 1.309 . . . . 5.27 110.45 -176.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 77.88 171.98 0.2 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 125.543 1.537 . . . . 4.5 110.613 -171.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.88 67.2 0.04 OUTLIER Glycine 0 CA--C 1.459 -3.463 0 C-N-CA 120.522 -0.847 . . . . 3.06 111.81 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -58.28 122.71 13.88 Favored 'General case' 0 N--CA 1.404 -2.763 0 CA-C-N 113.084 -1.558 . . . . 3.17 110.054 176.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -63.26 108.52 1.31 Allowed 'General case' 0 C--O 1.24 0.578 0 N-CA-C 108.507 -0.923 . . . . 3.23 108.507 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.6 tp -116.38 18.7 15.1 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.359 -0.837 . . . . 1.6 110.572 -170.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' A' ' 11' ' ' ARG . 13.0 p -62.61 137.87 58.36 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.362 -0.835 . . . . 1.86 111.954 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.95 -157.97 19.63 Favored Glycine 0 N--CA 1.435 -1.39 0 CA-C-N 115.72 -0.673 . . . . 1.11 112.795 178.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -87.98 104.88 17.05 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 123.261 0.624 . . . . 2.07 110.003 -179.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.401 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 10.2 p90 -113.23 13.08 19.13 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.785 -0.643 . . . . 0.51 111.207 -175.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.66 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 38.5 mt -52.11 -25.23 8.34 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.608 1.707 . . . . 1.12 115.608 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -100.24 -10.26 21.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 2.04 111.121 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -79.97 119.79 23.29 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.805 -0.443 . . . . 2.01 109.805 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.89 151.1 38.97 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.161 -0.472 . . . . 4.79 109.862 -175.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.641 ' HA ' HG12 ' A' ' 38' ' ' ILE . 68.9 m-85 -68.53 -37.07 79.68 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 116.305 -0.407 . . . . 0.43 110.585 -176.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -57.85 -29.26 64.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.165 0.507 . . . . 2.79 110.969 175.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -83.11 -31.46 27.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.711 -0.677 . . . . 0.88 111.22 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.641 HG12 ' HA ' ' A' ' 35' ' ' PHE . 34.9 pt -93.84 24.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.185 0.517 . . . . 1.25 111.922 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 36.24 91.03 Favored Glycine 0 N--CA 1.453 -0.183 0 CA-C-N 115.292 -0.867 . . . . 0.66 113.582 176.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.801 ' HH ' ' HG ' ' A' ' 17' ' ' SER . 0.6 OUTLIER -114.53 122.17 45.74 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.182 0.515 . . . . 1.67 112.129 179.61 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.72 148.72 24.62 Favored 'General case' 0 CA--C 1.485 -1.552 0 N-CA-C 107.821 -1.177 . . . . 1.06 107.821 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 46' ' ' MET . 31.1 p -54.75 -33.99 61.96 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 113.556 0.946 . . . . 1.52 113.556 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.699 ' HA ' ' HE1' ' A' ' 46' ' ' MET . 6.8 tt -66.38 -45.24 80.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.066 -0.716 . . . . 2.24 109.066 178.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.41 87.49 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.099 -0.501 . . . . 1.13 110.043 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 55.6 tp -62.9 -39.36 94.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.273 -0.876 . . . . 1.15 111.185 178.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.699 ' HE1' ' HA ' ' A' ' 43' ' ' LEU . 65.5 mtm -64.08 -31.27 72.4 Favored 'General case' 0 C--O 1.199 -1.596 0 C-N-CA 120.66 -0.416 . . . . 2.13 110.969 177.199 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.55 -34.28 77.87 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.521 0.677 . . . . 1.88 110.191 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.547 HG21 HD13 ' A' ' 14' ' ' LEU . 35.8 m -64.12 -59.47 4.4 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 106.859 -1.534 . . . . 1.18 106.859 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.31 -38.08 70.78 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.05 -1.432 . . . . 1.02 110.16 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.0 80.84 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.242 0.617 . . . . 1.12 112.533 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -64.45 -36.39 84.0 Favored 'General case' 0 C--O 1.226 -0.171 0 N-CA-C 109.618 -0.512 . . . . 3.59 109.618 179.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.466 HD21 HD11 ' A' ' 5' ' ' LEU . 83.8 mt -64.97 -45.4 85.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.75 -0.659 . . . . 1.61 111.181 176.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 43.9 mt-10 -56.27 -50.53 71.11 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 122.845 0.458 . . . . 0.48 109.881 176.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -61.82 -43.21 99.31 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.68 -1.146 . . . . 1.75 110.095 -177.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.462 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 31.3 ttm180 -65.94 -52.39 50.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.334 -0.394 . . . . 3.52 111.902 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.462 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 85.3 m-85 -92.97 -17.55 23.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.376 1.251 . . . . 1.35 114.376 -170.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.8 53.11 4.71 Favored Glycine 0 C--N 1.312 -0.75 0 C-N-CA 119.99 -1.1 . . . . 0.93 110.762 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.09 140.66 43.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 N-CA-C 108.544 -0.909 . . . . 1.72 108.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 p -93.78 115.13 27.52 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 112.194 0.442 . . . . 2.39 112.194 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.2 mt -104.42 118.05 57.65 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.553 -0.906 . . . . 1.21 108.553 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -57.53 123.35 13.57 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.594 2.196 . . . . 1.09 111.313 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -50.38 -47.82 56.11 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.488 1.115 . . . . 1.83 113.692 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.31 -32.69 70.55 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 120.885 0.374 . . . . 2.34 110.641 -176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.26 -41.11 57.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 108.584 -0.895 . . . . 1.24 108.584 179.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.28 -33.96 68.17 Favored 'General case' 0 C--O 1.214 -0.78 0 C-N-CA 123.712 0.805 . . . . 1.13 111.589 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -90.41 -17.01 54.32 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.434 -0.889 . . . . 0.61 112.76 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -101.57 7.36 42.28 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.587 0.958 . . . . 4.72 113.587 -177.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.7 m -77.3 114.22 17.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 106.904 -1.517 . . . . 1.15 106.904 171.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -90.36 -34.69 15.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 121.619 0.723 . . . . 1.91 110.527 -173.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 67.9 p -117.42 142.52 30.45 Favored Pre-proline 0 N--CA 1.411 -2.423 0 CA-C-N 115.343 -0.844 . . . . 1.16 109.961 179.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.66 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 76.9 Cg_exo -55.5 -28.9 66.72 Favored 'Trans proline' 0 CA--C 1.499 -1.24 0 C-N-CA 123.866 3.044 . . . . 0.36 111.946 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -50.3 -51.71 42.85 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 124.425 1.078 . . . . 1.84 109.668 174.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -65.67 -42.48 91.26 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 115.101 -0.954 . . . . 2.13 111.249 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.726 HD22 HD12 ' A' ' 10' ' ' LEU . 5.0 tt -66.49 -44.07 83.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.964 -0.754 . . . . 1.56 108.964 -177.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -56.98 -51.86 67.54 Favored 'General case' 0 C--O 1.245 0.854 0 C-N-CA 123.525 0.73 . . . . 1.12 109.226 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.35 -44.07 92.72 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.813 -1.085 . . . . 0.57 111.407 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.7 tp -57.85 -50.06 74.59 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.751 0.82 . . . . 2.48 111.341 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.7 mt -70.55 -40.29 77.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.393 -0.523 . . . . 1.19 110.724 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.424 ' OD1' HD23 ' A' ' 4' ' ' LEU . 13.8 m-80 -60.99 -39.63 90.4 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.48 0.181 . . . . 1.14 110.745 177.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.85 -39.78 64.67 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.314 -0.469 . . . . 0.53 112.445 178.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.65 -45.03 65.91 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.838 0.352 . . . . 1.22 110.936 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.584 ' HB3' HD13 ' A' ' 4' ' ' LEU . 21.5 mt -69.36 -15.5 63.33 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.402 0.681 . . . . 1.97 112.486 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.2 73.76 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-O 121.526 0.679 . . . . 1.26 109.182 173.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -93.34 -67.08 0.88 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.432 -0.804 . . . . 2.44 109.605 177.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.06 104.03 4.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.258 -0.883 . . . . 2.12 112.011 -173.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.84 0 N-CA-C 107.113 -1.439 . . . . 3.84 107.113 179.567 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 mmt . . . . . 0 N--CA 1.47 0.568 0 CA-C-O 120.888 0.375 . . . . 6.86 111.128 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.63 25.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.644 0.735 . . . . 4.54 109.69 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.47 HG23 ' CD1' ' A' ' 56' ' ' TYR . 52.0 m -87.8 105.49 17.44 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-O 122.033 0.921 . . . . 3.27 111.865 -177.001 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.524 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 28.9 tp 175.25 156.15 0.17 Allowed 'General case' 0 N--CA 1.405 -2.709 0 CA-C-N 113.084 -1.871 . . . . 1.89 106.227 172.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.524 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 85.9 mt -120.14 123.67 43.9 Favored 'General case' 0 N--CA 1.406 -2.665 0 N-CA-C 108.273 -1.01 . . . . 1.38 108.273 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.7 p -98.37 -179.87 4.49 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 106.585 -1.635 . . . . 1.29 106.585 172.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.737 HG23 ' HA ' ' A' ' 29' ' ' ASP . 20.6 m -59.47 -31.93 69.78 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 118.638 0.654 . . . . 1.31 110.505 175.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.24 -46.72 63.89 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.44 -0.578 . . . . 1.65 109.44 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -64.51 -39.54 93.96 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.589 -0.732 . . . . 1.41 109.527 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.543 HD12 HD12 ' A' ' 74' ' ' LEU . 15.0 tp -65.49 -51.38 60.48 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 114.893 -1.048 . . . . 1.23 109.195 -177.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -52.32 -40.65 62.15 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 3.04 111.766 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.539 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 60.6 ttt180 -54.3 -54.52 39.09 Favored 'General case' 0 C--O 1.24 0.577 0 O-C-N 123.549 0.531 . . . . 4.47 110.586 176.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.46 -39.13 89.76 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.536 -0.756 . . . . 1.19 111.547 -175.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.8 -50.99 68.84 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.162 0.288 . . . . 2.05 111.174 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.8 t -63.52 -34.72 69.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 CA-C-O 120.999 0.428 . . . . 1.33 111.46 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.539 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 95.6 mt-10 -63.22 -49.31 74.68 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.245 0.545 . . . . 2.05 111.218 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 p -82.23 -8.13 59.64 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.473 -0.785 . . . . 1.66 112.889 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.483 ' HB2' ' HH ' ' A' ' 40' ' ' TYR . . . -64.0 -26.85 68.75 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.581 0.705 . . . . 1.58 110.26 177.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.22 -52.97 4.81 Favored Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 109.749 -1.34 . . . . 2.32 109.749 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -62.06 109.18 1.21 Allowed 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.253 1.021 . . . . 5.17 108.75 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.9 m -113.77 27.39 9.58 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.538 1.161 . . . . 5.27 109.391 -177.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -74.39 -64.09 1.1 Allowed 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.666 -1.605 . . . . 4.5 106.666 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 157.78 67.49 0.01 OUTLIER Glycine 0 N--CA 1.409 -3.11 0 C-N-CA 119.604 -1.284 . . . . 3.06 113.618 176.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 t -79.74 73.01 6.47 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 107.566 -1.272 . . . . 3.17 107.566 170.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -57.89 125.28 22.37 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.027 -0.988 . . . . 3.23 111.434 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -132.87 26.31 4.3 Favored 'General case' 0 C--N 1.282 -2.344 0 N-CA-C 107.059 -1.46 . . . . 1.6 107.059 -171.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.3 p -53.6 134.46 41.23 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 114.401 -1.272 . . . . 1.86 112.799 -174.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.32 -161.52 27.67 Favored Glycine 0 N--CA 1.43 -1.734 0 CA-C-N 114.842 -1.072 . . . . 1.11 110.969 177.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.737 ' HA ' HG23 ' A' ' 7' ' ' THR . 10.2 m-20 -77.7 126.33 30.7 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.064 -0.717 . . . . 2.07 109.064 177.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -123.32 19.08 9.8 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.943 -0.762 . . . . 0.51 108.943 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.499 ' O ' ' HB ' ' A' ' 70' ' ' THR . 29.3 mt -53.63 -23.19 10.39 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.58 1.326 . . . . 1.12 114.58 -175.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -92.0 -22.53 19.93 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.894 0.378 . . . . 2.04 110.475 -176.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.59 114.09 16.08 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.824 -1.176 . . . . 2.01 107.824 -178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -75.72 146.74 39.87 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 120.128 -0.629 . . . . 4.79 109.631 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.532 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.5 m-85 -55.22 -40.88 71.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.993 -0.549 . . . . 0.43 111.424 -175.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.06 -34.78 63.87 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.814 -0.63 . . . . 2.79 111.724 178.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.2 -34.23 32.42 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.143 -0.481 . . . . 0.88 110.259 -174.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 pt -90.8 17.7 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 113.118 0.784 . . . . 1.25 113.118 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.81 14.47 67.47 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 114.564 0.586 . . . . 0.66 114.564 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.532 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 32.6 m-85 -101.33 115.17 29.88 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 120.796 0.331 . . . . 1.67 111.418 -179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -87.22 154.54 20.63 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.427 -1.694 . . . . 1.06 106.427 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.548 ' O ' ' HG3' ' A' ' 46' ' ' MET . 44.1 p -51.44 -27.88 11.46 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 113.509 0.929 . . . . 1.52 113.509 177.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.565 ' HA ' ' HE1' ' A' ' 46' ' ' MET . 3.0 tm? -64.35 -57.76 8.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.162 -0.681 . . . . 2.24 109.162 177.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.68 78.25 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.23 0.538 . . . . 1.13 110.391 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 57.8 tp -62.69 -33.6 75.4 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.121 -0.945 . . . . 1.15 110.95 179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.565 ' HE1' ' HA ' ' A' ' 43' ' ' LEU . 69.3 mtm -65.81 -29.76 70.29 Favored 'General case' 0 C--O 1.199 -1.559 0 C-N-CA 120.164 -0.615 . . . . 2.13 112.084 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.441 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 36.2 tt0 -65.79 -29.12 69.56 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.803 0.811 . . . . 1.88 109.505 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 24.6 m -64.62 -58.01 7.5 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 106.193 -1.78 . . . . 1.18 106.193 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.33 -38.44 74.11 Favored 'General case' 0 C--O 1.2 -1.523 0 CA-C-N 113.875 -1.512 . . . . 1.02 110.759 176.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.66 -45.31 81.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.531 0.732 . . . . 1.12 112.348 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.511 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 50.6 mtt180 -64.83 -38.63 91.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.744 -0.662 . . . . 3.59 109.572 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 86.7 mt -65.71 -41.39 92.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.055 -0.975 . . . . 1.61 110.271 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 37.7 mt-10 -57.0 -54.85 42.11 Favored 'General case' 0 CA--C 1.502 -0.885 0 O-C-N 123.624 0.577 . . . . 0.48 109.813 175.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.3 t -62.33 -38.5 89.7 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.501 -0.772 . . . . 1.75 111.928 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.497 ' CZ ' ' HH ' ' A' ' 56' ' ' TYR . 66.9 ttt180 -68.1 -51.02 51.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.693 0.627 . . . . 3.52 112.693 177.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.497 ' HH ' ' CZ ' ' A' ' 55' ' ' ARG . 65.0 m-85 -93.77 -12.38 29.25 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.749 1.018 . . . . 1.35 113.749 -171.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.63 17.94 79.45 Favored Glycine 0 C--N 1.308 -1.006 0 C-N-CA 120.698 -0.763 . . . . 0.93 111.285 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.442 HG11 ' HB2' ' A' ' 56' ' ' TYR . 7.5 p -98.38 135.06 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 N-CA-C 107.948 -1.13 . . . . 1.72 107.948 -178.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 m -92.87 118.45 31.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.997 -0.742 . . . . 2.39 108.997 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.1 mt -103.29 117.55 59.96 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.548 -0.908 . . . . 1.21 108.548 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.34 128.19 29.1 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.839 2.359 . . . . 1.09 110.977 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -51.28 -38.75 54.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.363 1.065 . . . . 1.83 111.943 -177.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.68 -45.31 79.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.901 -0.591 . . . . 2.34 110.652 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.99 -36.06 56.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 O-C-N 123.428 0.455 . . . . 1.24 109.879 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.48 -32.17 64.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.475 -0.784 . . . . 1.13 111.365 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.506 ' HA3' ' HB2' ' A' ' 42' ' ' SER . . . -116.98 23.13 10.15 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.5 -0.857 . . . . 0.61 112.297 178.097 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -101.15 -22.16 14.76 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.45 0.643 . . . . 4.72 110.334 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' A' ' 74' ' ' LEU . 17.8 m -76.19 130.8 35.89 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 CA-C-N 114.984 -1.007 . . . . 1.15 111.594 -175.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.43 -50.09 6.78 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.706 -0.679 . . . . 1.91 111.343 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 32.2 p -109.13 149.23 39.4 Favored Pre-proline 0 N--CA 1.405 -2.701 0 CA-C-N 115.846 -0.615 . . . . 1.16 110.479 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.494 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 89.3 Cg_exo -51.82 -38.81 68.32 Favored 'Trans proline' 0 C--O 1.211 -0.831 0 C-N-CA 123.269 2.646 . . . . 0.36 112.228 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.42 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 13.6 ptt180 -55.63 -35.17 65.6 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.676 0.991 . . . . 1.84 113.676 176.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -63.78 -50.62 68.29 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.791 0.805 . . . . 2.13 109.137 176.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.543 HD12 HD12 ' A' ' 10' ' ' LEU . 3.4 tm? -66.57 -47.22 73.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.319 -1.31 . . . . 1.56 109.906 -176.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 51.4 tp -56.78 -48.77 77.12 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.646 0.778 . . . . 1.12 110.735 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.68 -44.05 82.82 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.346 -0.388 . . . . 0.57 111.52 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.11 -47.94 83.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.004 -0.544 . . . . 2.48 109.565 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.15 -35.21 52.44 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 C-N-CA 120.158 -0.617 . . . . 1.19 111.439 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.1 -44.02 82.8 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 117.969 0.35 . . . . 1.14 110.8 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.18 -43.33 98.77 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.541 -0.624 . . . . 0.53 111.541 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.58 -25.77 65.06 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.974 0.416 . . . . 1.22 111.271 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 66.6 mt -79.58 -40.66 28.9 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 116.207 -0.451 . . . . 1.97 110.513 177.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.89 -34.2 76.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.439 0.638 . . . . 1.26 110.174 177.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -86.04 3.47 42.2 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.457 -0.792 . . . . 2.44 112.277 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.17 90.71 7.91 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.825 0.345 . . . . 2.12 110.709 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.369 0 N-CA-C 107.579 -1.267 . . . . 3.84 107.579 -178.485 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 110.457 -0.201 . . . . 6.86 110.457 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 67.49 34.58 4.6 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 123.966 0.906 . . . . 4.54 111.1 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.1 t -81.34 106.97 13.73 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.305 -1.368 . . . . 3.27 107.305 176.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 tp -68.59 154.27 42.21 Favored 'General case' 0 N--CA 1.407 -2.6 0 CA-C-N 113.154 -1.839 . . . . 1.89 112.498 -172.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.421 HD22 ' CZ ' ' A' ' 56' ' ' TYR . 96.4 mt -101.66 131.34 47.94 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 114.419 -1.264 . . . . 1.38 108.941 176.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p -102.22 -176.44 3.12 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.963 -1.495 . . . . 1.29 106.963 170.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.702 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.0 m -58.14 -39.7 79.44 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 118.284 0.493 . . . . 1.31 111.371 177.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.84 -42.53 94.84 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.104 0.478 . . . . 1.65 110.05 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -67.89 -41.19 83.14 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.685 -0.689 . . . . 1.41 109.601 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.421 HD11 ' CD1' ' A' ' 74' ' ' LEU . 28.0 tp -64.82 -43.82 91.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.762 -1.108 . . . . 1.23 110.539 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.526 ' HD3' ' O ' ' A' ' 26' ' ' LEU . 40.3 ttp180 -49.93 -41.74 46.92 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.471 0.708 . . . . 3.04 111.92 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.408 ' HG2' ' OE2' ' A' ' 16' ' ' GLU . 40.6 ttm180 -55.47 -43.76 75.8 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.915 0.76 . . . . 4.47 111.116 -177.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.466 ' HB1' HD21 ' A' ' 52' ' ' LEU . . . -63.68 -42.08 98.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.239 -0.437 . . . . 1.19 110.839 -178.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.588 HD13 HG23 ' A' ' 48' ' ' THR . 3.8 mm? -64.83 -37.06 86.34 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.358 -0.383 . . . . 2.05 110.519 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.64 -53.31 32.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 N-CA-C 109.937 -0.394 . . . . 1.33 109.937 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.408 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.9 mt-10 -58.97 -40.6 85.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.902 -0.59 . . . . 2.05 112.503 -177.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.9 p -77.01 -15.29 59.67 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.998 -0.681 . . . . 1.66 112.465 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.86 -58.03 3.27 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.845 -0.798 . . . . 1.58 108.845 177.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.59 56.11 23.34 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.627 -0.715 . . . . 2.32 111.906 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -126.19 160.85 29.11 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 109.607 -0.516 . . . . 5.17 109.607 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.3 m -86.11 33.37 0.61 Allowed 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 121.515 0.674 . . . . 5.27 112.277 -172.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -146.69 136.24 22.98 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 121.893 -0.505 . . . . 4.5 109.883 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -93.61 87.95 1.2 Allowed Glycine 0 N--CA 1.418 -2.537 0 N-CA-C 108.5 -1.84 . . . . 3.06 108.5 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.448 HG23 HD12 ' A' ' 26' ' ' LEU . 6.8 t -61.47 179.07 0.25 Allowed 'General case' 0 CA--C 1.573 1.836 0 C-N-CA 123.381 0.672 . . . . 3.17 112.629 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.46 80.3 4.86 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.24 0.83 . . . . 3.23 113.24 -172.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.526 ' O ' ' HD3' ' A' ' 11' ' ' ARG . 9.5 mp -121.45 8.64 10.19 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.432 -1.258 . . . . 1.6 108.038 174.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.2 m -66.57 138.86 57.78 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.19 -1.368 . . . . 1.86 109.986 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.54 -124.16 12.44 Favored Glycine 0 N--CA 1.439 -1.113 0 N-CA-C 110.263 -1.135 . . . . 1.11 110.263 -177.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.702 ' HA ' HG21 ' A' ' 7' ' ' THR . 6.6 p-10 -115.28 122.37 45.75 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 108.591 -0.892 . . . . 2.07 108.591 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.32 19.49 15.51 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.49 0.662 . . . . 0.51 109.518 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.631 ' O ' ' HB ' ' A' ' 70' ' ' THR . 59.5 mt -51.98 -32.08 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 114.716 1.376 . . . . 1.12 114.716 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -94.73 -1.88 52.15 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.101 0.477 . . . . 2.04 112.007 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp -81.34 129.52 34.66 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.722 -0.844 . . . . 2.01 108.722 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 142.61 43.77 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 108.033 -1.099 . . . . 4.79 108.033 -177.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.552 ' HA ' HG12 ' A' ' 38' ' ' ILE . 73.2 m-85 -60.13 -41.8 93.45 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 120.546 -0.462 . . . . 0.43 109.8 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.25 -27.02 61.7 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.039 -0.528 . . . . 2.79 112.101 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.19 -34.47 37.39 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.651 -0.87 . . . . 0.88 108.651 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.552 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.8 pt -91.64 16.95 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.049 0.452 . . . . 1.25 110.803 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.84 55.77 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.55 -0.75 . . . . 0.66 113.701 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -118.09 108.93 15.82 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 113.156 0.798 . . . . 1.67 113.156 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.35 147.45 26.52 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 106.924 -1.51 . . . . 1.06 106.924 174.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.513 ' O ' ' HG3' ' A' ' 46' ' ' MET . 18.0 p -50.87 -31.04 16.14 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 114.237 1.199 . . . . 1.52 114.237 -178.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.769 ' HA ' ' HE1' ' A' ' 46' ' ' MET . 5.4 tt -63.77 -53.94 43.06 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.226 -1.028 . . . . 2.24 108.226 177.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.51 -35.24 79.83 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.29 0.567 . . . . 1.13 110.32 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.445 ' O ' ' HB ' ' A' ' 48' ' ' THR . 59.8 tp -61.57 -37.71 84.84 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.352 -0.84 . . . . 1.15 111.615 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.769 ' HE1' ' HA ' ' A' ' 43' ' ' LEU . 59.9 mtm -63.78 -33.4 75.57 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 120.735 -0.386 . . . . 2.13 110.657 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -66.78 -32.18 73.3 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 121.946 0.879 . . . . 1.88 109.805 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.588 HG23 HD13 ' A' ' 14' ' ' LEU . 55.6 m -66.52 -55.86 13.57 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.411 -1.329 . . . . 1.18 107.411 178.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.92 -38.21 69.97 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.72 -1.582 . . . . 1.02 109.855 177.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.85 80.26 Favored 'General case' 0 C--O 1.251 1.17 0 C-N-CA 123.099 0.56 . . . . 1.12 112.45 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 -66.31 -38.72 88.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.967 -0.561 . . . . 3.59 109.724 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.466 HD21 ' HB1' ' A' ' 13' ' ' ALA . 85.4 mt -63.98 -45.68 87.98 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.422 -0.808 . . . . 1.61 110.498 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.8 mt-10 -56.53 -49.6 74.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.83 -0.623 . . . . 0.48 110.084 176.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.2 t -62.37 -54.73 36.17 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.983 -1.008 . . . . 1.75 110.894 -177.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.91 -38.13 89.94 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.375 0.879 . . . . 3.52 113.375 -174.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.421 ' CZ ' HD22 ' A' ' 5' ' ' LEU . 99.4 m-85 -98.7 -9.52 24.5 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 114.504 1.298 . . . . 1.35 114.504 -173.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.42 50.58 8.11 Favored Glycine 0 C--N 1.316 -0.557 0 C-N-CA 120.278 -0.963 . . . . 0.93 111.792 178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.3 p -142.61 175.48 4.42 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 N-CA-C 106.96 -1.496 . . . . 1.72 106.96 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.6 t -142.22 139.34 31.97 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 119.19 0.905 . . . . 2.39 109.802 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.475 HD12 ' HB3' ' A' ' 49' ' ' ALA . 70.5 mt -114.1 129.46 24.79 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 108.043 -1.095 . . . . 1.21 108.043 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.73 113.98 2.21 Favored 'Trans proline' 0 C--O 1.245 0.844 0 C-N-CA 122.005 1.803 . . . . 1.09 109.742 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -55.49 -29.72 59.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.612 0.765 . . . . 1.83 113.004 -176.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -68.63 -41.03 80.02 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.823 -0.436 . . . . 2.34 109.823 178.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.2 t -75.17 -34.79 32.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.163 -0.68 . . . . 1.24 109.163 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.08 65.54 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.694 -0.685 . . . . 1.13 110.99 176.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -91.8 -3.74 68.1 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.591 -0.814 . . . . 0.61 112.76 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -101.37 -14.45 17.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.333 0.587 . . . . 4.72 110.829 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.4 m -76.17 124.25 33.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 CA-C-O 121.047 0.451 . . . . 1.15 109.904 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -92.29 -33.18 14.73 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 115.915 -0.584 . . . . 1.91 111.712 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.631 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 40.2 p -125.63 152.25 71.75 Favored Pre-proline 0 N--CA 1.418 -2.037 0 CA-C-N 115.645 -0.707 . . . . 1.16 110.085 -177.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . 0.577 ' HB2' HD22 ' A' ' 31' ' ' LEU . 54.2 Cg_exo -56.37 -26.3 61.73 Favored 'Trans proline' 0 C--O 1.2 -1.409 0 C-N-CA 123.57 2.846 . . . . 0.36 111.109 176.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -51.22 -57.21 9.4 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.84 0.856 . . . . 1.84 109.961 174.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -64.32 -41.11 96.99 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.463 -0.789 . . . . 2.13 110.885 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.421 ' CD1' HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -67.54 -46.17 73.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.47 -0.786 . . . . 1.56 110.691 -177.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.6 tp -57.6 -52.16 66.56 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.007 -0.738 . . . . 1.12 109.007 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -52.39 -44.6 65.43 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.811 1.244 . . . . 0.57 111.414 177.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 67.9 tp -62.38 -51.3 68.11 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.732 0.813 . . . . 2.48 111.197 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 58.8 mt -66.33 -39.75 84.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.165 -0.47 . . . . 1.19 110.119 -178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.95 -43.8 86.58 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.411 -0.359 . . . . 1.14 110.121 176.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 84' ' ' GLU . . . -64.23 -42.7 97.8 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.575 -0.739 . . . . 0.53 112.003 178.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.84 79.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.757 0.313 . . . . 1.22 110.746 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.58 -36.65 84.39 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.647 0.379 . . . . 1.97 110.978 176.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.83 -34.65 78.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.069 -0.514 . . . . 1.26 110.6 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 80' ' ' GLY . 42.1 mt-10 -75.39 -32.79 60.89 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.299 -0.41 . . . . 2.44 110.499 178.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 106.52 1.91 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.308 0.575 . . . . 2.12 110.982 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.439 0 CA-C-N 115.306 -0.861 . . . . 3.84 108.821 178.84 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.6 tp . . . . . 0 N--CA 1.389 -3.509 0 N-CA-C 108.636 -0.876 . . . . 1.51 108.636 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.5 HD21 ' CE2' ' A' ' 56' ' ' TYR . 88.7 mt -116.19 130.91 57.02 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 108.193 -1.04 . . . . 0.8 108.193 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.3 p -102.02 -174.82 2.67 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 108.017 -1.105 . . . . 0.63 108.017 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.912 HG21 ' HA ' ' A' ' 29' ' ' ASP . 12.0 m -57.01 -45.71 82.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.02 0.438 . . . . 0.61 110.278 178.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 18.0 t70 -57.22 -45.17 84.12 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.861 0.864 . . . . 1.65 111.298 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 5' ' ' LEU . 15.4 m-20 -67.1 -39.66 86.75 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.367 0.603 . . . . 1.41 110.102 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.4 HD11 ' CD1' ' A' ' 74' ' ' LEU . 9.8 tp -65.94 -42.46 90.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.099 -0.955 . . . . 0.48 109.04 -177.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.476 ' O ' HG23 ' A' ' 15' ' ' VAL . 39.0 ttm180 -53.02 -48.74 67.33 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.135 -0.939 . . . . 2.46 109.518 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.557 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 48.3 mtt180 -54.03 -44.53 71.06 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.016 -0.993 . . . . 3.93 111.648 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.93 91.7 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.53 0.519 . . . . 0.5 110.719 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.42 HD12 HG21 ' A' ' 48' ' ' THR . 9.4 mp -67.3 -31.64 72.07 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.998 0.37 . . . . 1.44 111.998 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 11' ' ' ARG . 95.6 t -64.75 -48.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 N-CA-C 108.581 -0.896 . . . . 0.8 108.581 175.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 47.0 mt-10 -58.14 -48.03 81.49 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.623 -0.717 . . . . 2.05 110.991 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.9 p . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.305 0.854 . . . . 1.39 113.305 -177.998 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.912 ' HA ' HG21 ' A' ' 7' ' ' THR . 5.2 m-20 . . . . . 0 CA--C 1.483 -1.609 0 N-CA-C 109.521 -0.548 . . . . 2.07 109.521 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' HD13 ' A' ' 33' ' ' LEU . 18.7 p90 -109.0 14.13 24.24 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.093 -0.706 . . . . 0.44 109.093 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.776 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 67.2 mt -53.54 -26.85 22.91 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 113.608 0.966 . . . . 0.39 113.608 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -95.11 -11.01 29.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.3 -0.409 . . . . 2.04 111.274 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.5 mp -82.05 116.25 21.56 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.659 -0.867 . . . . 1.37 108.659 175.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -75.7 149.89 37.99 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 115.287 -0.87 . . . . 3.94 110.426 -173.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.485 ' HA ' HG12 ' A' ' 38' ' ' ILE . 56.7 m-85 -61.96 -39.84 93.52 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.423 -0.353 . . . . 0.35 111.097 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -58.01 -31.99 67.49 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.401 0.619 . . . . 2.79 111.137 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -82.37 -26.01 33.29 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.349 -0.841 . . . . 0.88 111.246 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.485 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.3 pt -98.07 14.42 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.097 0.475 . . . . 0.6 111.245 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.39 40.96 99.73 Favored Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.767 -0.651 . . . . 0.66 113.116 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.447 ' HB2' HG13 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -115.97 113.96 23.97 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.482 -0.562 . . . . 1.33 109.482 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -85.83 156.94 20.35 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.338 -0.616 . . . . 1.06 109.338 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 46' ' ' MET . 24.4 p -53.39 -33.75 54.99 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.108 0.781 . . . . 1.03 113.108 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.3 -49.13 70.66 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.927 -0.768 . . . . 1.56 108.927 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.51 96.62 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 109.605 -0.517 . . . . 0.43 109.605 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 68' ' ' VAL . 63.8 tp -60.62 -41.65 95.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.995 -1.002 . . . . 0.43 111.223 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.8 mtp -61.68 -40.58 95.47 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-N 116.609 -0.269 . . . . 1.49 110.344 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 34.5 tt0 -65.42 -34.86 79.29 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.471 0.653 . . . . 1.88 110.511 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.42 HG21 HD12 ' A' ' 14' ' ' LEU . 60.1 m -64.03 -56.74 12.88 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 107.252 -1.388 . . . . 0.45 107.252 178.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.55 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.0 -36.27 70.21 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 113.923 -1.489 . . . . 0.27 109.995 176.546 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.512 ' HA ' ' OE1' ' A' ' 53' ' ' GLU . . . -58.68 -40.99 85.16 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.466 0.706 . . . . 0.33 112.414 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 62.6 mtp85 -63.35 -42.32 98.9 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.376 -0.972 . . . . 2.84 108.376 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.32 -41.75 89.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.389 -1.278 . . . . 0.9 111.185 178.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.512 ' OE1' ' HA ' ' A' ' 50' ' ' ALA . 50.2 mt-10 -55.81 -53.2 59.57 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 123.262 0.625 . . . . 0.48 109.836 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.8 m -62.49 -46.62 87.61 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 114.938 -1.028 . . . . 1.19 111.357 -178.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -65.46 -45.78 82.43 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.7 -0.682 . . . . 3.07 112.373 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.5 ' CE2' HD21 ' A' ' 5' ' ' LEU . 94.0 m-85 -97.19 6.37 48.55 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.179 0.807 . . . . 1.01 113.179 -175.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.29 52.72 49.82 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 115.984 -0.553 . . . . 0.93 112.188 177.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.526 HG11 HD12 ' A' ' 82' ' ' LEU . 28.6 m -132.86 176.52 8.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.665 -0.494 . . . . 1.16 109.665 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 t -141.9 129.62 21.62 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.95 -1.13 . . . . 1.87 107.95 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.55 HD12 ' HB1' ' A' ' 49' ' ' ALA . 92.9 mt -106.93 124.19 36.16 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.926 -0.579 . . . . 0.57 109.513 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 126.5 21.73 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.048 2.499 . . . . 0.87 111.719 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -52.99 -30.75 36.99 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.809 1.244 . . . . 1.83 113.43 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 11.4 t70 -69.82 -47.65 61.99 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.276 -0.639 . . . . 2.34 109.276 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -72.4 -33.25 45.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.495 -0.775 . . . . 0.66 110.618 -174.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.69 -27.42 62.89 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.862 -0.608 . . . . 0.51 111.443 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.85 19.43 8.91 Favored Glycine 0 N--CA 1.434 -1.455 0 N-CA-C 111.06 -0.816 . . . . 0.61 111.06 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 14.5 tpp180 -100.9 -19.27 15.98 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.254 -0.647 . . . . 3.98 109.254 -178.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.461 HG23 HD21 ' A' ' 45' ' ' LEU . 30.2 m -79.05 123.7 36.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-N 115.04 -0.982 . . . . 0.44 111.615 -177.394 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -91.71 -31.78 15.68 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.279 -0.873 . . . . 1.91 110.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 21.5 p -125.22 145.25 50.02 Favored Pre-proline 0 N--CA 1.418 -2.034 0 CA-C-N 115.337 -0.847 . . . . 0.47 110.395 -176.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.776 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 77.1 Cg_exo -54.03 -32.1 67.24 Favored 'Trans proline' 0 C--O 1.215 -0.648 0 C-N-CA 123.732 2.954 . . . . 0.32 113.192 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -52.9 -43.38 66.14 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.222 0.326 . . . . 1.48 111.774 176.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -64.55 -48.05 76.51 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.595 0.758 . . . . 2.13 109.978 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.458 ' HB2' HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -66.4 -42.09 88.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.925 -1.034 . . . . 0.9 110.114 -176.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.07 -52.31 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.552 -0.536 . . . . 0.34 109.552 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.7 -43.32 94.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.5 -0.773 . . . . 0.57 111.763 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.61 -46.9 87.58 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 109.781 -0.451 . . . . 1.96 109.781 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.79 -35.42 55.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 C-N-CA 120.944 -0.302 . . . . 0.55 110.583 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -40.79 89.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 120.689 0.28 . . . . 1.14 110.47 175.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.01 -32.43 69.6 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.776 -0.647 . . . . 0.53 112.449 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.12 60.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.819 0.819 . . . . 0.6 109.641 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.526 HD12 HG11 ' A' ' 58' ' ' VAL . 8.5 mp -72.62 -6.7 46.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.075 -0.966 . . . . 1.42 111.724 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.549 0.69 . . . . 0.85 109.904 170.598 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.1 tp . . . . . 0 N--CA 1.418 -2.074 0 CA-C-O 121.485 0.66 . . . . 1.51 110.714 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.532 HD11 HD12 ' A' ' 52' ' ' LEU . 73.8 mt -98.9 133.27 43.42 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.604 -0.726 . . . . 0.8 110.024 -178.025 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 p -99.92 -176.6 3.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.457 -1.312 . . . . 0.63 107.457 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.675 HG21 ' HA ' ' A' ' 29' ' ' ASP . 16.7 m -57.64 -38.86 75.76 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.11 -0.7 . . . . 0.61 109.11 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -60.03 -47.43 85.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.781 -1.1 . . . . 1.65 111.272 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.22 -39.76 89.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.835 -0.621 . . . . 1.41 110.098 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 17.3 tp -65.08 -45.05 86.85 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.943 -1.026 . . . . 0.48 109.265 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 11' ' ' ARG . 36.8 ttm180 -50.75 -54.56 22.35 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 124.0 0.92 . . . . 2.46 109.914 177.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 23.3 ttp180 -56.05 -46.33 78.94 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.67 -1.15 . . . . 3.93 111.689 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.535 ' HB1' HD21 ' A' ' 52' ' ' LEU . . . -62.16 -40.65 96.7 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.367 0.417 . . . . 0.5 111.281 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.12 -38.65 91.82 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.634 0.254 . . . . 1.44 111.34 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 11' ' ' ARG . 89.3 t -66.71 -47.59 82.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.857 -0.423 . . . . 0.8 109.857 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 45.9 mt-10 -59.37 -39.69 84.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.289 -0.414 . . . . 2.05 111.021 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.573 ' CB ' ' HA ' ' A' ' 48' ' ' THR . 20.6 m . . . . . 0 C--N 1.309 -1.16 0 CA-C-O 121.302 0.573 . . . . 1.39 112.114 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.675 ' HA ' HG21 ' A' ' 7' ' ' THR . 19.9 t70 . . . . . 0 N--CA 1.437 -1.116 0 N-CA-C 108.609 -0.885 . . . . 2.07 108.609 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.442 ' HB2' HD12 ' A' ' 33' ' ' LEU . 25.1 p90 -101.32 14.92 30.47 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.431 -0.35 . . . . 0.44 111.624 -175.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.72 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 41.0 mt -52.75 -25.62 11.72 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.919 1.451 . . . . 0.39 114.919 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -92.19 -16.94 25.56 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.945 0.402 . . . . 2.04 111.315 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 30' ' ' PHE . 81.2 mt -77.53 114.78 16.72 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 121.308 0.575 . . . . 1.37 109.735 -176.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HG2' HG22 ' A' ' 70' ' ' THR . 46.1 mtp180 -72.64 141.01 48.31 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.19 -0.914 . . . . 3.94 109.903 -172.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 38.9 m-85 -60.69 -39.35 88.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.501 -0.318 . . . . 0.35 110.258 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -56.7 -31.78 64.83 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.517 0.727 . . . . 2.79 111.142 177.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -82.65 -34.34 27.52 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.087 -0.506 . . . . 0.88 110.91 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.468 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.1 pt -90.79 9.71 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 112.511 0.56 . . . . 0.6 112.511 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.51 29.88 31.63 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.639 -0.709 . . . . 0.66 114.401 174.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 8.6 m-85 -111.59 121.46 45.21 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 117.25 0.525 . . . . 1.33 111.271 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -84.65 152.62 23.66 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 107.093 -1.447 . . . . 1.06 107.093 173.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.443 ' O ' ' HG3' ' A' ' 46' ' ' MET . 13.5 p -54.27 -30.44 50.57 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.914 0.709 . . . . 1.03 112.914 176.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.33 -52.37 54.32 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.08 -0.711 . . . . 1.56 109.08 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.26 -33.04 74.63 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.372 0.606 . . . . 0.43 110.247 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.543 HD21 HG23 ' A' ' 68' ' ' VAL . 44.8 tp -63.48 -46.73 84.81 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.51 -0.768 . . . . 0.43 110.199 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.549 ' HG2' ' HB1' ' A' ' 65' ' ' ALA . 70.8 mtm -63.92 -33.95 76.87 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.392 -0.367 . . . . 1.49 111.129 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.9 -33.48 75.41 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 121.957 0.884 . . . . 1.88 109.032 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.573 ' HA ' ' CB ' ' A' ' 17' ' ' SER . 86.5 m -68.99 -62.21 1.47 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.747 -1.115 . . . . 0.45 108.845 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.456 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.77 -25.32 54.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.912 -1.04 . . . . 0.27 111.575 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -43.65 84.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 123.288 0.635 . . . . 0.33 110.668 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -66.38 -37.41 85.21 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.108 -0.951 . . . . 2.84 110.769 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.535 HD21 ' HB1' ' A' ' 13' ' ' ALA . 3.9 mm? -62.66 -43.7 98.14 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 122.315 0.246 . . . . 0.9 110.431 177.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 59' ' ' SER . 43.1 mt-10 -58.0 -48.15 80.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 123.67 0.606 . . . . 0.48 110.638 175.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 m -63.4 -53.96 44.25 Favored 'General case' 0 CA--C 1.559 1.29 0 CA-C-O 121.196 0.522 . . . . 1.19 112.282 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -62.3 -38.04 87.87 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.948 0.899 . . . . 3.07 112.938 -174.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -102.29 -1.24 31.49 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 114.098 1.148 . . . . 1.01 114.098 -177.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.79 52.14 52.58 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 111.195 -0.762 . . . . 0.93 111.195 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.56 HG22 ' H ' ' A' ' 59' ' ' SER . 7.4 p -136.18 178.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 108.287 -1.005 . . . . 1.16 108.287 -174.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.56 ' H ' HG22 ' A' ' 58' ' ' VAL . 7.0 p -138.59 137.33 36.87 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-O 121.032 0.444 . . . . 1.87 109.977 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.456 HD12 ' HB1' ' A' ' 49' ' ' ALA . 87.2 mt -113.53 132.74 22.39 Favored Pre-proline 0 C--N 1.293 -1.881 0 N-CA-C 108.628 -0.878 . . . . 0.57 108.628 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -61.71 123.36 12.53 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 122.196 1.93 . . . . 0.87 111.012 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -53.42 -31.74 46.6 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.315 1.046 . . . . 1.83 111.018 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.66 -49.16 69.63 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.853 -1.067 . . . . 2.34 111.04 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.691 HG11 ' HG ' ' A' ' 77' ' ' LEU . 40.9 t -72.88 -33.81 44.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 109.805 -0.443 . . . . 0.66 109.805 -176.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.549 ' HB1' ' HG2' ' A' ' 46' ' ' MET . . . -58.05 -24.43 58.35 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.979 0.733 . . . . 0.51 112.979 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.63 2.81 34.25 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.495 -0.86 . . . . 0.61 112.364 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -108.1 -9.54 15.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.298 0.481 . . . . 3.98 112.298 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.543 HG23 HD21 ' A' ' 45' ' ' LEU . 15.5 m -79.35 111.42 16.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 121.465 0.65 . . . . 0.44 111.448 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -91.87 -31.93 15.5 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-N 115.667 -0.697 . . . . 1.91 110.219 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.423 HG22 ' HG2' ' A' ' 34' ' ' ARG . 41.1 p -121.69 145.31 42.76 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 115.325 -0.852 . . . . 0.47 111.016 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.72 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 56.8 Cg_exo -55.83 -34.17 90.57 Favored 'Trans proline' 0 C--O 1.212 -0.78 0 C-N-CA 123.916 3.078 . . . . 0.32 113.214 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 3.5 ptp180 -51.8 -45.86 64.02 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.346 0.403 . . . . 1.48 111.804 176.12 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -64.54 -44.83 89.56 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.532 0.682 . . . . 2.13 110.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.84 -47.65 68.39 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.952 -1.022 . . . . 0.9 110.657 -177.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 40.8 tp -58.48 -51.77 68.45 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.635 0.374 . . . . 0.34 110.95 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -58.71 -38.54 78.53 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.324 0.39 . . . . 0.57 110.93 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.691 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -62.49 -49.81 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.444 -0.576 . . . . 1.96 109.444 178.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.6 mt -67.34 -36.87 77.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.455 -0.339 . . . . 0.55 110.248 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -61.79 -37.06 82.96 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.873 -0.418 . . . . 1.14 109.873 176.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.51 -37.13 78.15 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.68 -0.691 . . . . 0.53 111.944 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.19 -44.86 67.83 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.189 0.519 . . . . 0.6 109.957 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.8 mt -66.96 -20.55 65.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 1.42 111.692 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.774 0 C-N-CA 122.979 0.511 . . . . 0.85 110.898 177.329 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 29.8 tp . . . . . 0 N--CA 1.388 -3.55 0 N-CA-C 103.937 -2.616 . . . . 1.51 103.937 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.434 ' HG ' HD11 ' A' ' 82' ' ' LEU . 92.1 mt -89.53 123.05 33.28 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 108.82 -0.807 . . . . 0.8 108.82 178.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.7 p -101.87 -173.91 2.46 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 107.313 -1.365 . . . . 0.63 107.313 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.501 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.6 m -57.23 -42.47 81.45 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.153 -0.684 . . . . 0.61 109.153 173.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.28 -48.91 79.85 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.424 1.089 . . . . 1.65 110.821 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -68.79 -39.54 80.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 116.027 -0.533 . . . . 1.41 111.421 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.434 HD22 HD13 ' A' ' 75' ' ' LEU . 18.6 tp -67.01 -45.2 78.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.795 -0.638 . . . . 0.48 109.978 -177.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 15' ' ' VAL . 43.8 ttp-105 -53.81 -45.78 70.91 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.559 -0.746 . . . . 2.46 109.882 177.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.545 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 66.9 mtp180 -55.84 -43.82 77.4 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.058 -0.974 . . . . 3.93 112.11 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.408 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -61.18 -45.43 94.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 123.73 0.644 . . . . 0.5 110.217 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 mp -65.52 -30.8 71.6 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.245 0.461 . . . . 1.44 112.245 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 11' ' ' ARG . 48.2 t -72.83 -34.69 47.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.156 -0.683 . . . . 0.8 109.156 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 44.2 mt-10 -66.19 -42.04 89.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.455 -0.338 . . . . 2.05 111.493 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.555 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 4.7 p . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 113.896 1.073 . . . . 1.39 113.896 -177.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.501 ' HA ' HG21 ' A' ' 7' ' ' THR . 3.8 m-20 . . . . . 0 CA--C 1.495 -1.144 0 N-CA-C 108.32 -0.993 . . . . 2.07 108.32 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 14.9 p90 -128.86 11.81 6.15 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.734 -0.786 . . . . 0.44 111.348 -177.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.851 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 44.8 mt -53.02 -29.13 27.7 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.735 1.383 . . . . 0.39 114.735 -176.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -98.73 -6.08 30.18 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.964 0.411 . . . . 2.04 111.842 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.7 mp -82.33 124.51 30.05 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.807 -0.812 . . . . 1.37 108.807 178.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -76.04 143.58 41.32 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 116.47 -0.332 . . . . 3.94 110.855 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.443 ' HA ' HG12 ' A' ' 38' ' ' ILE . 77.2 m-85 -63.68 -44.1 94.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.463 -0.335 . . . . 0.35 111.014 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -57.95 -26.23 61.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.085 0.469 . . . . 2.79 111.75 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.46 -30.45 27.22 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.168 -0.469 . . . . 0.88 110.681 -176.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.443 HG12 ' HA ' ' A' ' 35' ' ' PHE . 33.9 pt -92.32 19.05 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 121.122 0.487 . . . . 0.6 112.06 -176.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.41 34.3 54.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.047 -0.597 . . . . 0.66 112.011 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -116.19 118.71 33.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 121.467 0.651 . . . . 1.33 112.162 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -85.82 151.14 24.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 106.939 -1.504 . . . . 1.06 106.939 172.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.401 ' O ' ' HG3' ' A' ' 46' ' ' MET . 32.7 p -55.0 -32.27 61.66 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.342 0.497 . . . . 1.03 112.342 176.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 tt -63.92 -50.08 70.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.659 -0.867 . . . . 1.56 108.659 176.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.56 -38.81 88.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.901 -0.59 . . . . 0.43 109.789 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.539 HD21 HG23 ' A' ' 68' ' ' VAL . 57.7 tp -61.72 -46.41 89.77 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.329 -0.851 . . . . 0.43 110.334 177.17 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.401 ' HG3' ' O ' ' A' ' 42' ' ' SER . 73.1 mtm -62.56 -37.39 85.97 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 116.456 -0.338 . . . . 1.49 111.278 177.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 29.8 tt0 -63.83 -35.47 80.74 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.539 0.685 . . . . 1.88 110.285 176.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.8 m -65.6 -53.25 44.35 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.227 -1.397 . . . . 0.45 107.227 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.439 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.83 -38.63 72.89 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.19 -1.368 . . . . 0.27 110.033 175.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.92 -44.99 91.43 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 123.96 0.904 . . . . 0.33 112.061 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 53.2 mtt180 -62.68 -38.78 91.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.701 -0.851 . . . . 2.84 108.701 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 13' ' ' ALA . 96.6 mt -65.87 -41.18 91.92 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.041 -0.981 . . . . 0.9 111.212 177.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -55.7 -55.32 33.54 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.086 -0.709 . . . . 0.48 109.086 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.8 m -62.42 -51.24 68.31 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.534 -1.212 . . . . 1.19 112.433 -177.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -65.77 -38.09 88.11 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.037 0.754 . . . . 3.07 113.037 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -100.29 3.63 43.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 114.121 1.156 . . . . 1.01 114.121 -175.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.27 52.16 51.5 Favored Glycine 0 N--CA 1.459 0.193 0 N-CA-C 111.501 -0.64 . . . . 0.93 111.501 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.462 HG22 ' H ' ' A' ' 59' ' ' SER . 8.6 p -141.57 177.41 3.43 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 N-CA-C 107.853 -1.165 . . . . 1.16 107.853 -176.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.462 ' H ' HG22 ' A' ' 58' ' ' VAL . 10.8 t -141.55 155.61 45.77 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 119.271 0.942 . . . . 1.87 108.819 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.439 HD12 ' HB1' ' A' ' 49' ' ' ALA . 73.4 mt -135.35 125.76 16.94 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 109.054 -0.721 . . . . 0.57 109.054 -176.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.13 124.84 16.85 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.115 2.543 . . . . 0.87 112.09 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.567 1.321 . . . . 1.83 114.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.578 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 15.3 t70 -71.03 -34.77 71.62 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.007 -0.677 . . . . 2.34 110.664 -176.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.39 -35.17 56.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.603 -0.888 . . . . 0.66 108.603 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -24.7 63.62 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.173 -0.921 . . . . 0.51 110.938 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.4 1.67 55.99 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.093 -0.575 . . . . 0.61 112.463 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 34.6 mmt180 -97.16 -17.58 19.81 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 122.243 -0.563 . . . . 3.98 110.3 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.539 HG23 HD21 ' A' ' 45' ' ' LEU . 30.6 m -76.43 109.94 11.16 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-O 122.045 0.926 . . . . 0.44 109.749 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -93.4 -30.83 14.89 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-N 115.033 -0.985 . . . . 1.91 109.224 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 32.9 p -118.76 136.0 23.99 Favored Pre-proline 0 N--CA 1.402 -2.841 0 CA-C-N 114.315 -1.311 . . . . 0.47 110.15 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.851 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 85.5 Cg_exo -50.58 -30.74 29.19 Favored 'Trans proline' 0 CA--C 1.51 -0.703 0 C-N-CA 124.218 3.279 . . . . 0.32 114.084 -178.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -51.72 -44.86 63.38 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 123.313 0.383 . . . . 1.48 110.891 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -67.89 -45.47 74.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 124.403 1.081 . . . . 2.13 110.03 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.515 HD23 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -66.62 -44.15 82.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.829 -1.078 . . . . 0.9 109.864 -176.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.434 HD13 HD22 ' A' ' 10' ' ' LEU . 42.8 tp -57.14 -52.64 64.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.309 -0.626 . . . . 0.34 109.309 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.27 -44.68 75.85 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.14 0.976 . . . . 0.57 111.706 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.47 -52.05 67.26 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 115.028 -0.987 . . . . 1.96 110.219 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 52.1 mt -69.4 -39.25 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.774 -0.648 . . . . 0.55 110.282 -178.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -55.98 -46.31 78.68 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.32 0.248 . . . . 1.14 111.122 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.02 -43.85 96.64 Favored Glycine 0 N--CA 1.445 -0.762 0 O-C-N 123.832 0.707 . . . . 0.53 111.545 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.78 -38.21 73.4 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 122.652 0.381 . . . . 0.6 111.565 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.434 HD11 ' HG ' ' A' ' 5' ' ' LEU . 68.5 mt -66.55 -35.14 79.51 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 122.452 0.301 . . . . 1.42 111.794 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.745 0 CA-C-N 115.707 -0.679 . . . . 0.85 111.065 178.2 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.1 tp . . . . . 0 N--CA 1.396 -3.134 0 CA-C-O 121.383 0.611 . . . . 1.51 111.126 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.74 HD21 HD22 ' A' ' 52' ' ' LEU . 68.9 mt -91.57 124.28 35.61 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 124.025 0.93 . . . . 0.8 111.317 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.4 p -97.52 -177.81 3.93 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.276 -1.379 . . . . 0.63 107.276 170.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.69 HG21 ' HA ' ' A' ' 29' ' ' ASP . 8.5 m -58.19 -41.72 84.57 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 109.209 -0.663 . . . . 0.61 109.209 174.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -65.44 -43.04 91.68 Favored 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 115.609 -0.723 . . . . 1.65 112.071 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.413 ' HB3' HD23 ' A' ' 5' ' ' LEU . 12.3 m-20 -64.91 -39.65 93.85 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.577 -0.527 . . . . 1.41 109.577 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.593 HD11 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -65.4 -56.26 13.54 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 114.785 -1.098 . . . . 0.48 109.424 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -49.18 -47.97 45.5 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.693 1.197 . . . . 2.46 111.18 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -56.65 -46.16 81.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.853 -1.067 . . . . 3.93 111.154 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.67 77.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.466 -0.788 . . . . 0.5 111.736 -176.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.412 HD13 HG21 ' A' ' 48' ' ' THR . 4.0 mm? -63.74 -57.16 10.82 Favored 'General case' 0 C--O 1.246 0.895 0 N-CA-C 109.298 -0.63 . . . . 1.44 109.298 175.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -54.48 -50.34 58.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-N 114.916 -1.038 . . . . 0.8 111.317 -175.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -61.05 -30.07 70.11 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.268 0.47 . . . . 2.05 112.268 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 C--N 1.318 -0.799 0 CA-C-O 121.041 0.448 . . . . 1.39 112.065 -177.718 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.69 ' HA ' HG21 ' A' ' 7' ' ' THR . 8.4 m-20 . . . . . 0 CA--C 1.489 -1.398 0 N-CA-C 108.73 -0.841 . . . . 2.07 108.73 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -94.34 18.94 10.21 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.373 -0.831 . . . . 0.44 111.436 -174.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.718 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 63.4 mt -53.7 -24.93 16.2 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.197 1.184 . . . . 0.39 114.197 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.18 -19.56 19.96 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.22 0.533 . . . . 2.04 110.812 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.8 mt -80.36 128.34 33.44 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.715 -0.675 . . . . 1.37 109.887 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.72 155.37 35.69 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.126 -0.488 . . . . 3.94 109.996 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -67.1 -44.14 80.75 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 120.872 -0.331 . . . . 0.35 110.432 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.2 -24.64 64.97 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.6 0.714 . . . . 2.79 110.533 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.78 -30.73 40.76 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.462 -0.79 . . . . 0.88 110.057 -177.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.5 pt -98.33 13.11 4.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 112.126 0.417 . . . . 0.6 112.126 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.02 48.96 18.22 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 115.881 -0.599 . . . . 0.66 112.91 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -134.37 118.33 17.33 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.699 0.629 . . . . 1.33 112.699 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -91.04 161.52 15.09 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.073 -0.512 . . . . 1.06 109.888 172.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.496 ' O ' ' HG3' ' A' ' 46' ' ' MET . 56.0 p -54.98 -29.44 56.99 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.476 1.287 . . . . 1.03 114.476 -179.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.11 -50.82 64.58 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 117.991 0.36 . . . . 1.56 110.424 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.98 86.71 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.68 0.752 . . . . 0.43 109.637 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.659 ' O ' ' HB ' ' A' ' 48' ' ' THR . 29.8 tp -63.87 -40.63 97.0 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.706 -1.134 . . . . 0.43 110.989 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.5 mtm -64.58 -37.06 86.26 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 121.774 -0.579 . . . . 1.49 112.02 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.73 -28.58 68.54 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.103 0.954 . . . . 1.88 109.829 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.659 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 62.5 m -64.89 -53.84 40.18 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.57 -1.641 . . . . 0.45 106.57 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.496 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -56.49 -36.21 68.87 Favored 'General case' 0 C--O 1.205 -1.287 0 CA-C-N 114.341 -1.299 . . . . 0.27 110.041 174.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.77 -40.76 80.53 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 122.917 0.487 . . . . 0.33 112.032 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.1 mtp85 -64.79 -39.3 93.37 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.654 0.74 . . . . 2.84 109.159 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.74 HD22 HD21 ' A' ' 5' ' ' LEU . 64.4 mt -65.27 -44.67 87.28 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.429 -1.26 . . . . 0.9 109.413 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 42.8 mt-10 -55.97 -50.55 70.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.541 -0.754 . . . . 0.48 110.227 176.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.1 m -62.99 -49.55 74.26 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.659 -0.701 . . . . 1.19 112.025 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -63.68 -44.06 94.83 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.446 0.536 . . . . 3.07 112.446 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -94.65 -7.45 40.8 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.08 0.77 . . . . 1.01 113.08 -173.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 69.39 51.54 26.25 Favored Glycine 0 C--O 1.24 0.483 0 N-CA-C 111.298 -0.721 . . . . 0.93 111.298 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 59' ' ' SER . 11.0 p -141.3 176.86 4.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 N-CA-C 107.62 -1.252 . . . . 1.16 107.62 -176.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.416 ' H ' HG22 ' A' ' 58' ' ' VAL . 17.7 t -139.06 132.23 29.78 Favored 'General case' 0 N--CA 1.424 -1.755 0 N-CA-C 108.433 -0.951 . . . . 1.87 108.433 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' HB1' ' A' ' 49' ' ' ALA . 67.0 mt -104.59 123.14 41.25 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.003 -0.999 . . . . 0.57 108.933 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.532 ' HB2' HG23 ' A' ' 64' ' ' VAL . 36.9 Cg_exo -58.79 118.28 5.14 Favored 'Trans proline' 0 C--O 1.25 1.11 0 C-N-CA 122.373 2.049 . . . . 0.87 110.413 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.92 -26.87 38.94 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.699 0.799 . . . . 1.83 112.759 -176.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.96 -28.92 65.95 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 116.114 -0.493 . . . . 2.34 110.749 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.532 HG23 ' HB2' ' A' ' 61' ' ' PRO . 67.2 t -76.99 -48.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 N-CA-C 108.509 -0.923 . . . . 0.66 108.509 177.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.66 -30.74 63.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.955 -1.02 . . . . 0.51 112.097 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -89.15 -5.19 73.41 Favored Glycine 0 N--CA 1.439 -1.127 0 C-N-CA 120.051 -1.071 . . . . 0.61 113.009 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -98.53 -14.99 19.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.97 0.73 . . . . 3.98 112.97 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.53 HG21 HD23 ' A' ' 74' ' ' LEU . 26.7 m -79.66 121.56 33.18 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 CA-C-O 121.09 0.472 . . . . 0.44 110.933 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -93.16 -39.08 11.23 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.629 0.728 . . . . 1.91 110.911 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.45 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 34.9 p -115.42 138.47 23.73 Favored Pre-proline 0 N--CA 1.413 -2.316 0 CA-C-N 115.369 -0.832 . . . . 0.47 110.739 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.718 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 74.1 Cg_exo -52.75 -29.73 43.56 Favored 'Trans proline' 0 CA--C 1.508 -0.787 0 C-N-CA 124.34 3.36 . . . . 0.32 113.729 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -51.36 -44.93 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 123.439 0.462 . . . . 1.48 110.581 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 31.8 mt-10 -66.82 -49.28 66.29 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 123.982 0.913 . . . . 2.13 109.786 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.593 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -64.71 -43.61 92.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.743 -1.117 . . . . 0.9 110.193 -175.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' OD1' ' A' ' 79' ' ' ASN . 43.9 tp -57.28 -56.96 15.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 123.667 0.604 . . . . 0.34 109.98 178.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.66 -45.03 93.25 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 112.888 0.699 . . . . 0.57 112.888 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 73' ' ' GLU . 87.0 mt -61.77 -37.66 85.14 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 112.115 0.413 . . . . 1.96 112.115 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 64.7 mt -80.72 -35.57 14.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 C-N-CA 120.23 -0.588 . . . . 0.55 109.977 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.404 ' OD1' ' HG ' ' A' ' 75' ' ' LEU . 11.7 m120 -57.74 -40.94 80.84 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 110.383 -0.228 . . . . 1.14 110.383 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.61 -40.8 99.22 Favored Glycine 0 N--CA 1.45 -0.375 0 O-C-N 123.613 0.57 . . . . 0.53 112.033 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.27 -30.79 68.98 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.179 0.514 . . . . 0.6 110.458 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 86.6 mt -77.19 -34.19 56.26 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.719 -0.673 . . . . 1.42 110.444 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.684 0 CA-C-O 121.237 0.542 . . . . 0.85 110.777 177.054 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.3 mp . . . . . 0 C--O 1.25 1.081 0 N-CA-C 115.012 1.486 . . . . 1.51 115.012 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.493 HD11 HD22 ' A' ' 52' ' ' LEU . 82.3 mt -113.86 132.9 55.73 Favored 'General case' 0 CA--C 1.491 -1.319 0 CA-C-N 113.718 -1.583 . . . . 0.8 108.431 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.8 p -99.8 -174.78 2.79 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 108.909 -0.775 . . . . 0.63 108.909 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -57.75 -45.81 85.38 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.418 0.627 . . . . 0.61 109.31 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -61.18 -42.35 98.42 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 114.789 -1.096 . . . . 1.65 110.636 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.83 -40.73 88.1 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 115.666 -0.697 . . . . 1.41 111.413 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.417 HD11 HD12 ' A' ' 74' ' ' LEU . 15.9 tp -63.85 -38.44 91.1 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.539 -0.755 . . . . 0.48 109.31 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.523 ' O ' HG23 ' A' ' 15' ' ' VAL . 39.8 ttm105 -56.12 -54.35 46.17 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.526 -0.761 . . . . 2.46 109.998 173.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 8.6 tpt180 -57.43 -34.68 69.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 115.645 -0.707 . . . . 3.93 111.379 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.96 75.46 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.289 0.368 . . . . 0.5 110.275 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' OH ' ' A' ' 40' ' ' TYR . 10.6 mp -67.02 -24.28 66.0 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.116 0.413 . . . . 1.44 112.116 177.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 11' ' ' ARG . 97.2 t -68.46 -45.99 81.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.979 -0.749 . . . . 0.8 108.979 175.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 14.4 mm-40 -62.66 -44.95 94.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.698 -0.683 . . . . 2.05 112.829 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.569 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 3.9 p . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 112.64 0.608 . . . . 1.39 112.64 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 N--CA 1.444 -0.745 0 N-CA-C 108.551 -0.907 . . . . 2.07 108.551 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.485 ' HB2' HD12 ' A' ' 33' ' ' LEU . 18.6 p90 -126.48 20.33 7.31 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.896 -0.593 . . . . 0.44 109.947 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.768 ' HB3' ' HB2' ' A' ' 72' ' ' ARG . 22.2 mt -53.85 -31.31 49.02 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.144 1.164 . . . . 0.39 114.144 -178.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -95.63 -6.63 39.71 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.94 0.4 . . . . 2.04 111.24 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 30' ' ' PHE . 65.0 mt -82.18 109.96 16.95 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 106.796 -1.557 . . . . 1.37 106.796 176.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HD2' ' OD1' ' A' ' 69' ' ' ASP . 32.5 mtm105 -72.08 152.77 42.13 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.457 -0.571 . . . . 3.94 109.457 -173.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.63 -46.75 86.83 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.567 -0.531 . . . . 0.35 109.567 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -57.98 -23.28 53.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.814 0.446 . . . . 2.79 111.956 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -83.14 -28.74 29.19 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.165 0.507 . . . . 0.88 110.702 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.4 pt -97.24 13.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.303 0.573 . . . . 0.6 112.097 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.24 32.17 32.35 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.928 -0.653 . . . . 0.66 112.774 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.436 ' OH ' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-85 -115.97 105.48 12.7 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.169 0.509 . . . . 1.33 111.388 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -83.3 158.6 22.15 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.766 -1.198 . . . . 1.06 107.766 176.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.62 ' O ' ' HG3' ' A' ' 46' ' ' MET . 53.5 p -52.19 -31.08 30.0 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.377 0.88 . . . . 1.03 113.377 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.1 -51.32 64.57 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 120.982 0.42 . . . . 1.56 110.069 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.32 84.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.386 0.612 . . . . 0.43 109.886 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.492 HD21 HG23 ' A' ' 68' ' ' VAL . 52.9 tp -61.88 -45.44 93.75 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.43 110.717 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.62 ' HG3' ' O ' ' A' ' 42' ' ' SER . 54.0 mtt -62.81 -39.32 93.91 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 110.247 -0.279 . . . . 1.49 110.247 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -62.37 -37.64 86.48 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.768 0.795 . . . . 1.88 108.921 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.423 HG21 HD12 ' A' ' 14' ' ' LEU . 83.8 m -67.99 -57.63 5.85 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.502 -1.227 . . . . 0.45 108.082 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.521 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.06 -32.38 66.17 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 114.532 -1.213 . . . . 0.27 111.033 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.58 83.61 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.477 0.711 . . . . 0.33 111.721 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.569 ' NH2' ' HA ' ' A' ' 17' ' ' SER . 75.0 mtt180 -66.53 -39.9 88.85 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.84 -1.073 . . . . 2.84 109.064 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.493 HD22 HD11 ' A' ' 5' ' ' LEU . 90.3 mt -64.86 -40.56 95.35 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.143 -0.935 . . . . 0.9 110.029 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -56.3 -55.29 35.14 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.66 -0.7 . . . . 0.48 109.641 174.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.0 t -63.14 -44.38 95.69 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 115.096 -0.957 . . . . 1.19 111.731 -176.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.13 -49.6 71.51 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.817 0.673 . . . . 3.07 112.817 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.425 ' HB3' HD11 ' A' ' 82' ' ' LEU . 80.8 m-85 -94.13 -6.72 44.29 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 114.35 1.241 . . . . 1.01 114.35 -172.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.64 52.88 6.89 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.779 -1.2 . . . . 0.93 111.301 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.556 ' HB ' HD13 ' A' ' 82' ' ' LEU . 12.0 p -138.95 176.9 5.53 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 106.352 -1.721 . . . . 1.16 106.352 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 58' ' ' VAL . 17.1 t -141.7 145.08 34.46 Favored 'General case' 0 N--CA 1.415 -2.198 0 N-CA-C 108.712 -0.847 . . . . 1.87 108.712 177.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.521 HD12 ' HB1' ' A' ' 49' ' ' ALA . 64.4 mt -131.97 111.37 14.5 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.451 -1.314 . . . . 0.57 107.451 -178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.474 ' HB2' HG23 ' A' ' 64' ' ' VAL . 37.5 Cg_exo -62.02 128.97 25.67 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.7 2.267 . . . . 0.87 111.039 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 9.4 p-10 -55.06 -30.06 58.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.393 1.077 . . . . 1.83 112.48 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -68.36 -35.76 78.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.334 -0.617 . . . . 2.34 109.334 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.474 HG23 ' HB2' ' A' ' 61' ' ' PRO . 25.3 t -76.88 -47.68 27.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 108.382 -0.97 . . . . 0.66 108.382 176.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.15 -29.32 63.52 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 123.516 0.727 . . . . 0.51 112.509 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 42' ' ' SER . . . -85.55 -2.51 87.07 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.66 -0.781 . . . . 0.61 112.953 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -100.18 -24.62 14.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.639 0.219 . . . . 3.98 111.341 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.492 HG23 HD21 ' A' ' 45' ' ' LEU . 12.3 m -73.61 120.4 22.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.975 0.893 . . . . 0.44 111.728 -175.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 28.4 t70 -91.59 -47.48 7.38 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-N 114.233 -1.349 . . . . 1.91 112.386 -175.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 41.1 p -107.85 143.18 26.79 Favored Pre-proline 0 N--CA 1.408 -2.56 0 CA-C-N 116.014 -0.539 . . . . 0.47 110.91 -177.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.625 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 79.5 Cg_exo -53.74 -31.24 60.22 Favored 'Trans proline' 0 C--O 1.211 -0.839 0 C-N-CA 123.655 2.903 . . . . 0.32 111.706 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.768 ' HB2' ' HB3' ' A' ' 31' ' ' LEU . 25.0 ttp85 -51.4 -53.33 37.75 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 123.761 0.663 . . . . 1.48 111.03 174.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.84 -39.78 87.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.25 -0.432 . . . . 2.13 111.049 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.444 HD23 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -68.16 -44.85 75.05 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.406 -0.361 . . . . 0.9 111.207 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.2 tp -56.99 -50.06 73.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.22 -0.659 . . . . 0.34 109.22 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.54 -37.71 88.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.179 -0.918 . . . . 0.57 111.635 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.445 HD11 HG12 ' A' ' 64' ' ' VAL . 5.1 tt -58.3 -52.35 65.97 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 108.835 -0.802 . . . . 1.96 108.835 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.5 mt -64.56 -50.7 74.71 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 N-CA-C 109.131 -0.692 . . . . 0.55 109.131 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -51.2 -44.05 61.5 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.547 0.53 . . . . 1.14 111.871 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.55 -48.73 48.79 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 121.237 -0.506 . . . . 0.53 112.456 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.92 79.41 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.122 0.487 . . . . 0.6 111.276 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.556 HD13 ' HB ' ' A' ' 58' ' ' VAL . 17.5 tp -70.95 -33.32 70.37 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.707 -0.679 . . . . 1.42 110.248 -177.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.655 0 CA-C-O 120.899 0.38 . . . . 0.85 111.212 175.401 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.4 tp . . . . . 0 N--CA 1.409 -2.519 0 N-CA-C 109.564 -0.532 . . . . 1.51 109.564 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.37 124.58 48.19 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.318 -0.623 . . . . 0.8 109.318 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.7 p -104.26 -170.82 1.82 Allowed 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.727 -1.212 . . . . 0.63 107.727 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.823 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.9 m -56.07 -49.55 73.48 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.152 0.501 . . . . 0.61 110.035 177.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.32 -43.3 88.12 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 114.89 -1.05 . . . . 1.65 110.267 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.13 -43.2 78.87 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.594 -0.73 . . . . 1.41 110.814 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.585 HD11 HD12 ' A' ' 74' ' ' LEU . 14.3 tp -65.19 -38.16 89.59 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.121 -0.945 . . . . 0.48 109.946 -175.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.503 ' O ' HG23 ' A' ' 15' ' ' VAL . 36.8 ttp180 -51.01 -52.65 40.8 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.203 -0.908 . . . . 2.46 110.39 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.635 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 79.0 ttt180 -57.69 -42.77 84.34 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.021 -0.536 . . . . 3.93 111.982 -177.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.21 84.66 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.151 0.282 . . . . 0.5 110.663 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.605 HD23 HG21 ' A' ' 48' ' ' THR . 97.2 mt -65.85 -41.73 91.35 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.941 -0.572 . . . . 1.44 110.17 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 11' ' ' ARG . 57.3 t -61.59 -49.97 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.198 0.599 . . . . 0.8 110.111 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.635 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 48.1 mm-40 -57.35 -45.43 84.35 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.728 -0.669 . . . . 2.05 109.845 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.8 m . . . . . 0 C--N 1.312 -1.023 0 CA-C-N 115.456 -0.793 . . . . 1.39 112.547 -175.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.823 ' HA ' HG21 ' A' ' 7' ' ' THR . 29.0 t70 . . . . . 0 CA--C 1.507 -0.704 0 N-CA-C 108.898 -0.778 . . . . 2.07 108.898 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -121.86 22.2 10.47 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.96 -0.564 . . . . 0.44 111.142 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 55.6 mt -52.55 -19.47 2.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.417 1.636 . . . . 0.39 115.417 -177.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -92.97 -19.7 21.35 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.403 0.144 . . . . 2.04 111.345 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.23 122.22 26.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 1.37 110.281 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.531 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 34.6 mtm105 -77.8 145.85 36.14 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.962 -0.563 . . . . 3.94 109.798 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.56 ' HA ' HG12 ' A' ' 38' ' ' ILE . 46.6 m-85 -61.97 -42.08 98.73 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.582 -0.281 . . . . 0.35 110.795 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.94 -38.59 70.53 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.381 0.61 . . . . 2.79 110.24 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.11 -22.55 42.02 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.43 -0.805 . . . . 0.88 111.069 -173.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.6 pt -92.3 13.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.751 0.786 . . . . 0.6 110.55 177.233 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.91 87.5 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.571 -0.74 . . . . 0.66 113.81 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -81.83 131.86 35.27 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 112.189 0.441 . . . . 1.33 112.189 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.14 142.46 30.34 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.216 -1.772 . . . . 1.06 106.216 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 46' ' ' MET . 33.7 p -54.12 -31.98 53.76 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.522 0.934 . . . . 1.03 113.522 179.06 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.2 tp -64.68 -42.1 95.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.89 0.376 . . . . 1.56 110.234 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.62 -36.37 84.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.506 0.669 . . . . 0.43 109.709 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.505 HD21 HG23 ' A' ' 68' ' ' VAL . 54.7 tp -63.92 -45.23 90.2 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.205 -0.907 . . . . 0.43 109.931 176.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 42' ' ' SER . 83.3 mtp -61.89 -38.28 87.75 Favored 'General case' 0 C--O 1.196 -1.714 0 CA-C-N 115.931 -0.577 . . . . 1.49 110.258 176.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.8 tp10 -60.96 -35.2 76.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.806 0.842 . . . . 1.88 109.871 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.605 HG21 HD23 ' A' ' 14' ' ' LEU . 87.3 m -66.61 -57.33 7.44 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.566 -1.272 . . . . 0.45 107.566 -178.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.525 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.12 -43.61 74.26 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 113.725 -1.58 . . . . 0.27 109.567 177.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.07 91.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.75 0.82 . . . . 0.33 113.038 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 84.1 mtt180 -66.47 -38.27 86.96 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.23 -0.441 . . . . 2.84 109.989 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.62 -38.05 89.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.872 -0.604 . . . . 0.9 109.926 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.525 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -57.29 -55.12 38.83 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.642 -0.503 . . . . 0.48 109.642 173.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 59.2 p -61.19 -38.06 85.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.679 0.612 . . . . 1.19 112.504 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -71.01 -46.27 62.48 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.63 0.974 . . . . 3.07 113.63 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -101.74 -13.97 17.53 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 114.697 1.369 . . . . 1.01 114.697 -172.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.5 40.32 Favored Glycine 0 C--N 1.308 -0.986 0 C-N-CA 120.099 -1.048 . . . . 0.93 110.885 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.48 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 4.1 p -97.09 135.31 31.68 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 N-CA-C 109.126 -0.694 . . . . 1.16 109.126 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 m -96.77 106.07 18.3 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 109.92 -0.4 . . . . 1.87 109.92 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.408 ' CD1' ' HB1' ' A' ' 49' ' ' ALA . 67.9 mt -102.19 117.45 61.25 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 110.362 -0.236 . . . . 0.57 110.362 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.78 131.21 26.78 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.222 1.948 . . . . 0.87 110.329 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -51.88 -34.1 39.62 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.634 0.976 . . . . 1.83 113.634 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.634 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 3.4 m-20 -66.44 -45.62 79.22 Favored 'General case' 0 CA--C 1.495 -1.15 0 CA-C-O 120.566 0.222 . . . . 2.34 110.777 -178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.5 t -71.27 -31.68 44.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.538 -0.542 . . . . 0.66 109.538 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.82 -22.51 58.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.911 -0.586 . . . . 0.51 112.228 177.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.61 0.84 27.65 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 120.553 -0.832 . . . . 0.61 111.923 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 4.6 mmp_? -96.41 -15.11 21.98 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.185 -0.672 . . . . 3.98 109.185 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.525 HG21 HD23 ' A' ' 74' ' ' LEU . 19.5 m -76.85 91.84 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 CA-C-O 122.559 1.171 . . . . 0.44 109.641 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.531 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 18.9 t70 -86.23 -35.57 19.94 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 114.417 -1.265 . . . . 1.91 111.375 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.479 HG22 ' HG2' ' A' ' 34' ' ' ARG . 45.0 p -113.75 149.17 41.33 Favored Pre-proline 0 C--N 1.284 -2.255 0 N-CA-C 109.355 -0.609 . . . . 0.47 109.355 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.477 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.6 Cg_exo -52.27 -39.99 71.01 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.561 2.841 . . . . 0.32 112.949 -178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.9 ptp85 -50.86 -40.94 57.42 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 123.715 0.634 . . . . 1.48 112.52 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.01 -52.6 58.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.059 0.457 . . . . 2.13 110.802 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.585 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -67.86 -42.05 81.94 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.083 -0.962 . . . . 0.9 109.99 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' OD1' ' A' ' 79' ' ' ASN . 32.9 tp -56.41 -57.02 14.08 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.524 -0.762 . . . . 0.34 109.321 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.73 -39.2 80.17 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.926 -0.579 . . . . 0.57 112.253 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.04 -46.45 89.49 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.214 0.53 . . . . 1.96 109.633 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.44 -36.73 20.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-N 116.069 -0.514 . . . . 0.55 110.292 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.404 ' OD1' ' HG ' ' A' ' 75' ' ' LEU . 11.4 m120 -56.96 -47.03 81.69 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.223 0.209 . . . . 1.14 110.95 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.53 -39.68 97.67 Favored Glycine 0 N--CA 1.447 -0.592 0 O-C-N 123.552 0.533 . . . . 0.53 112.155 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.37 75.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.023 0.44 . . . . 0.6 110.518 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.9 mt -68.24 -33.97 75.36 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.97 -0.559 . . . . 1.42 110.691 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 123.428 0.691 . . . . 0.85 111.917 179.327 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.441 -0.876 0 N-CA-C 112.641 0.608 . . . . 1.51 112.641 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.492 HD22 ' OD1' ' A' ' 9' ' ' ASP . 88.3 mt -126.52 147.45 49.84 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 108.672 -0.862 . . . . 0.8 108.672 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.8 p -99.43 172.78 7.11 Favored 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 107.372 -1.344 . . . . 0.63 107.372 174.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.708 HG21 ' HA ' ' A' ' 29' ' ' ASP . 21.0 m -58.9 -31.25 68.44 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.278 -0.638 . . . . 0.61 109.278 172.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -66.02 -50.68 63.37 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.356 -0.838 . . . . 1.65 111.716 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.492 ' OD1' HD22 ' A' ' 5' ' ' LEU . 15.4 t70 -68.44 -37.8 80.57 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.347 -0.541 . . . . 1.41 109.909 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 75' ' ' LEU . 18.4 tp -62.67 -42.95 99.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.28 -0.873 . . . . 0.48 108.984 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 15' ' ' VAL . 42.2 ttp180 -50.35 -38.19 40.83 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 124.507 1.123 . . . . 2.46 111.12 178.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.694 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 59.6 ttt180 -56.25 -51.39 68.28 Favored 'General case' 0 C--O 1.216 -0.665 0 O-C-N 123.592 0.557 . . . . 3.93 110.724 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.45 -37.17 84.85 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 123.379 0.424 . . . . 0.5 111.909 -174.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.52 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.84 -29.66 69.64 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.312 -0.404 . . . . 1.44 111.296 176.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 11' ' ' ARG . 61.8 t -77.67 -39.97 27.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.401 -0.592 . . . . 0.8 109.401 176.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.694 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 6.7 mm-40 -55.99 -53.18 60.01 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.015 0.926 . . . . 2.05 110.655 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 115.552 -0.749 . . . . 1.39 111.866 -174.713 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.708 ' HA ' HG21 ' A' ' 7' ' ' THR . 12.0 t70 . . . . . 0 CA--C 1.496 -1.122 0 N-CA-C 108.049 -1.093 . . . . 2.07 108.049 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.439 ' CZ ' ' HG ' ' A' ' 14' ' ' LEU . 11.8 p90 -137.66 20.13 2.89 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.793 -0.363 . . . . 0.44 110.177 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.743 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 75.7 mt -54.98 -22.42 15.19 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.15 0.796 . . . . 0.39 113.15 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -92.12 -14.59 28.94 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.733 0.813 . . . . 2.04 111.0 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 30' ' ' PHE . 4.0 mm? -80.11 131.77 35.81 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 115.891 -0.595 . . . . 1.37 109.978 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.645 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 14.3 mmt180 -76.65 137.56 39.51 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.371 -0.603 . . . . 3.94 109.371 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.639 ' HB3' ' HB3' ' A' ' 40' ' ' TYR . 47.2 m-85 -62.76 -37.72 87.74 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 107.638 -1.245 . . . . 0.35 107.638 175.03 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -55.45 -33.92 64.03 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.418 -1.265 . . . . 2.79 110.332 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.3 -35.08 28.34 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 115.983 -0.553 . . . . 0.88 110.617 -176.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.467 HG13 ' HB2' ' A' ' 40' ' ' TYR . 38.0 pt -90.44 16.14 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.404 -0.518 . . . . 0.6 111.042 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 28.74 73.91 Favored Glycine 0 C--O 1.238 0.39 0 CA-C-N 115.341 -0.845 . . . . 0.66 113.236 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.639 ' HB3' ' HB3' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -97.37 114.03 25.78 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 109.469 -0.567 . . . . 1.33 109.469 -177.694 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.11 149.98 25.17 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 116.053 -0.521 . . . . 1.06 110.547 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 77.6 p -50.74 -33.94 25.09 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.916 1.08 . . . . 1.03 113.916 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.31 -49.42 69.55 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.841 -0.8 . . . . 1.56 108.841 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.07 -37.91 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.723 -0.671 . . . . 0.43 109.838 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.662 HD21 HG23 ' A' ' 68' ' ' VAL . 63.5 tp -62.95 -46.39 87.97 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.393 -0.821 . . . . 0.43 110.994 177.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 67.6 mtt -63.05 -36.56 83.99 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 110.168 -0.308 . . . . 1.49 110.168 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 37.9 tt0 -64.55 -31.26 72.4 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.501 0.667 . . . . 1.88 110.831 176.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.52 HG21 HD13 ' A' ' 14' ' ' LEU . 96.8 m -66.06 -55.49 16.29 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.462 -1.31 . . . . 0.45 107.462 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.508 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.71 -38.63 72.59 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 113.909 -1.496 . . . . 0.27 109.795 175.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.8 78.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.486 0.714 . . . . 0.33 111.63 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 71.3 mtt180 -63.67 -39.38 94.2 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.365 -0.834 . . . . 2.84 109.933 179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 59.2 mt -65.36 -41.96 93.27 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.068 0.396 . . . . 0.9 112.068 176.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.8 mt-10 -57.59 -48.62 78.9 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 122.325 0.25 . . . . 0.48 110.544 175.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -63.43 -44.51 94.36 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.389 0.614 . . . . 1.19 111.428 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -65.99 -44.12 85.78 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.154 -0.93 . . . . 3.07 112.844 -176.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.402 ' CE2' HD21 ' A' ' 5' ' ' LEU . 80.0 m-85 -101.57 -18.59 15.85 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 115.296 1.591 . . . . 1.01 115.296 -177.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.84 62.37 1.77 Allowed Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.257 -0.973 . . . . 0.93 111.434 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.1 m -139.21 177.77 4.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 C-N-CA 123.523 0.729 . . . . 1.16 110.125 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -140.22 115.95 10.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 123.632 0.583 . . . . 1.87 109.855 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.508 HD12 ' HB1' ' A' ' 49' ' ' ALA . 86.4 mt -101.01 130.31 25.34 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.461 -0.79 . . . . 0.57 110.294 -177.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.93 126.75 22.02 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.781 2.321 . . . . 0.87 111.647 176.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -51.35 -54.01 30.64 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.854 1.262 . . . . 1.83 113.658 -173.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.11 -28.45 63.29 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 116.235 -0.439 . . . . 2.34 111.66 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.79 -37.62 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.462 -0.94 . . . . 0.66 108.462 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.93 -24.99 60.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.105 -0.952 . . . . 0.51 111.377 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.56 11.98 39.16 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 121.057 -0.592 . . . . 0.61 112.618 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -105.23 -21.62 13.22 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.378 0.608 . . . . 3.98 110.535 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.662 HG23 HD21 ' A' ' 45' ' ' LEU . 28.6 m -76.64 115.67 18.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 121.597 0.713 . . . . 0.44 111.286 -176.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.645 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 33.3 t70 -97.79 -23.76 15.75 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 121.62 0.724 . . . . 1.91 110.533 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.431 HG22 ' HD3' ' A' ' 34' ' ' ARG . 70.7 p -116.75 143.97 32.45 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.512 -0.767 . . . . 0.47 110.897 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.743 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 39.4 Cg_exo -59.36 -30.82 93.74 Favored 'Trans proline' 0 C--O 1.204 -1.204 0 C-N-CA 123.308 2.672 . . . . 0.32 112.352 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.553 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 6.0 ptp180 -54.75 -44.78 73.91 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.12 -0.232 . . . . 1.48 111.329 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.2 -46.19 81.71 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.197 0.522 . . . . 2.13 109.829 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.461 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.1 -45.13 82.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.263 -0.881 . . . . 0.9 110.553 -176.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.515 ' HB2' HD22 ' A' ' 10' ' ' LEU . 61.8 tp -57.2 -54.19 49.59 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 109.454 -0.573 . . . . 0.34 109.454 176.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -59.99 -37.73 80.54 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 123.908 0.755 . . . . 0.57 111.804 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.92 -50.1 74.78 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 122.925 0.49 . . . . 1.96 110.522 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.8 mt -70.41 -31.13 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.566 -0.531 . . . . 0.55 109.566 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -62.32 -39.61 93.62 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-N 116.067 -0.515 . . . . 1.14 109.647 174.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.58 -38.9 93.7 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.857 -0.497 . . . . 0.53 111.857 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.84 -37.89 79.44 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.23 0.538 . . . . 0.6 110.194 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.7 mt -74.93 -20.92 59.49 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.908 -0.587 . . . . 1.42 111.117 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 121.027 0.441 . . . . 0.85 110.536 174.306 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.434 ' HA ' HD13 ' A' ' 82' ' ' LEU . 11.7 tp . . . . . 0 N--CA 1.411 -2.391 0 CA-C-O 121.237 0.541 . . . . 1.51 111.398 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.601 ' HG ' HD11 ' A' ' 82' ' ' LEU . 79.8 mt -98.5 129.07 45.08 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 115.091 -0.959 . . . . 0.8 108.42 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -96.6 -171.97 2.39 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 107.144 -1.428 . . . . 0.63 107.144 173.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 m -56.73 -38.91 73.03 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.265 0.555 . . . . 0.61 110.218 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.79 -41.1 60.63 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 111.367 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.94 -36.03 83.07 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.896 -0.779 . . . . 1.41 108.896 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.475 HD11 ' CD1' ' A' ' 74' ' ' LEU . 19.7 tp -66.21 -50.88 62.32 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.829 -1.078 . . . . 0.48 108.474 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.414 ' O ' HG23 ' A' ' 15' ' ' VAL . 11.9 ttp180 -50.33 -42.13 52.38 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.82 0.7 . . . . 2.46 111.509 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -53.21 -47.04 69.25 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.727 0.642 . . . . 3.93 110.325 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.569 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -66.06 -42.83 88.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.696 -0.684 . . . . 0.5 112.085 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.65 HD13 HG21 ' A' ' 48' ' ' THR . 4.1 mm? -64.08 -34.79 78.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.008 0.433 . . . . 1.44 111.157 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 11' ' ' ARG . 95.1 t -69.55 -25.03 27.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 120.997 0.427 . . . . 0.8 111.499 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 5.6 mm-40 -63.35 -45.96 88.76 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.174 0.511 . . . . 2.05 111.822 177.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 p . . . . . 0 C--N 1.315 -0.923 0 CA-C-O 121.443 0.64 . . . . 1.39 110.919 -179.588 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 CA--C 1.51 -0.59 0 N-CA-C 108.939 -0.763 . . . . 2.07 108.939 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -133.52 14.73 4.08 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.104 -0.638 . . . . 0.44 111.17 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.777 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 42.4 mt -52.86 -31.96 42.21 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 114.071 1.137 . . . . 0.39 114.071 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -94.29 -7.42 41.98 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 116.276 -0.42 . . . . 2.04 111.86 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mp -84.84 123.58 30.62 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.741 -1.207 . . . . 1.37 107.741 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -73.95 145.65 44.53 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 109.71 -0.478 . . . . 3.94 109.71 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.545 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 51.9 m-85 -61.49 -36.42 80.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.368 -0.605 . . . . 0.35 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -56.28 -36.78 68.99 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.318 -0.856 . . . . 2.79 110.726 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.9 -35.43 37.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.837 -0.62 . . . . 0.88 110.141 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -93.27 12.91 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 113.267 0.84 . . . . 0.6 113.267 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.49 41.11 30.91 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.051 -0.595 . . . . 0.66 114.27 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.545 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 13.7 m-85 -116.95 110.23 18.03 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 122.625 0.37 . . . . 1.33 110.724 176.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -88.46 155.09 19.86 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 120.562 -0.455 . . . . 1.06 110.313 174.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.416 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 79.4 p -51.94 -33.42 37.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.315 1.228 . . . . 1.03 114.315 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.26 -51.78 58.61 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.886 -0.413 . . . . 1.56 109.886 -178.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.49 89.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.498 0.666 . . . . 0.43 110.058 175.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.515 ' O ' ' HB ' ' A' ' 48' ' ' THR . 60.0 tp -62.37 -47.55 83.66 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.138 -0.937 . . . . 0.43 110.945 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 42' ' ' SER . 62.1 mtm -63.87 -37.23 86.61 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 122.443 -0.161 . . . . 1.49 110.796 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 40.2 tt0 -62.2 -31.43 71.95 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.49 0.662 . . . . 1.88 109.912 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.65 HG21 HD13 ' A' ' 14' ' ' LEU . 65.2 m -66.67 -56.9 8.49 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.591 -1.263 . . . . 0.45 107.591 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.506 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.34 -35.48 69.95 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 114.384 -1.28 . . . . 0.27 110.553 176.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.47 -44.05 84.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.411 0.684 . . . . 0.33 111.933 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.636 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 44.2 mtt180 -64.78 -37.12 86.54 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.303 -0.862 . . . . 2.84 109.412 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 13' ' ' ALA . 98.2 mt -67.62 -45.86 74.21 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.21 -0.905 . . . . 0.9 111.286 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.2 mt-10 -54.43 -51.99 63.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 123.093 0.557 . . . . 0.48 110.214 178.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 m -61.91 -48.85 78.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 114.943 -1.026 . . . . 1.19 111.829 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.46 HH11 ' HD3' ' A' ' 55' ' ' ARG . 12.0 ttm180 -65.6 -48.65 71.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.392 0.515 . . . . 3.07 112.392 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -91.86 2.57 56.44 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.215 0.82 . . . . 1.01 113.215 -171.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.71 56.5 18.74 Favored Glycine 0 C--O 1.25 1.102 0 CA-C-N 116.163 -0.471 . . . . 0.93 112.265 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.482 HG22 ' H ' ' A' ' 59' ' ' SER . 8.7 p -138.68 176.25 6.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 N-CA-C 107.962 -1.125 . . . . 1.16 107.962 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 58' ' ' VAL . 68.8 m -141.17 138.89 33.72 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 109.606 -0.516 . . . . 1.87 109.606 178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.506 HD12 ' HB1' ' A' ' 49' ' ' ALA . 65.6 mt -130.62 120.99 18.96 Favored Pre-proline 0 C--N 1.308 -1.223 0 N-CA-C 108.638 -0.875 . . . . 0.57 108.638 -177.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.416 ' HB2' HG23 ' A' ' 64' ' ' VAL . 38.1 Cg_exo -62.2 124.72 14.88 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.581 2.187 . . . . 0.87 110.175 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.408 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 5.4 p-10 -51.66 -31.53 25.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.713 1.205 . . . . 1.83 112.946 -177.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -69.02 -38.41 79.2 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.934 0.397 . . . . 2.34 110.546 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' A' ' 61' ' ' PRO . 21.3 t -75.59 -41.8 41.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.0 -1.111 . . . . 0.66 108.0 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -28.16 66.62 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 115.639 -0.71 . . . . 0.51 111.689 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.42 10.77 59.68 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 121.005 -0.617 . . . . 0.61 112.036 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -101.3 -24.39 14.23 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.837 -0.801 . . . . 3.98 108.837 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.568 HG21 HD23 ' A' ' 74' ' ' LEU . 30.3 m -79.14 97.55 2.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-O 122.245 1.022 . . . . 0.44 110.775 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -88.02 -21.01 25.03 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.273 -0.876 . . . . 1.91 111.221 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 p -121.39 142.87 36.31 Favored Pre-proline 0 N--CA 1.413 -2.319 0 CA-C-N 115.998 -0.546 . . . . 0.47 109.572 179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.777 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.7 Cg_exo -53.24 -34.9 71.8 Favored 'Trans proline' 0 CA--C 1.514 -0.478 0 C-N-CA 123.616 2.877 . . . . 0.32 113.34 -178.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -52.79 -44.22 66.43 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 123.475 0.485 . . . . 1.48 110.878 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB3' HG12 ' A' ' 68' ' ' VAL . 60.9 mm-40 -65.46 -47.96 74.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.262 0.625 . . . . 2.13 110.516 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.568 HD23 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -66.99 -42.93 84.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.323 -0.853 . . . . 0.9 110.333 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 51.1 tp -58.33 -50.2 74.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.636 -0.505 . . . . 0.34 109.636 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.42 -41.77 90.3 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.545 0.738 . . . . 0.57 111.094 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.97 -57.18 14.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.029 0.932 . . . . 1.96 108.738 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.3 mt -68.64 -31.85 52.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.51 0 CA-C-N 115.699 -0.682 . . . . 0.55 111.425 -176.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.77 -44.32 93.93 Favored 'General case' 0 N--CA 1.481 1.114 0 O-C-N 122.187 -0.32 . . . . 1.14 110.505 175.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.72 -39.58 90.21 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.378 -0.689 . . . . 0.53 111.378 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.62 -35.33 75.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.64 0.376 . . . . 0.6 111.455 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.601 HD11 ' HG ' ' A' ' 5' ' ' LEU . 55.6 mt -68.67 -31.96 71.46 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 122.927 0.491 . . . . 1.42 111.861 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.572 0 CA-C-O 121.217 0.532 . . . . 0.85 111.294 177.599 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.3 tp . . . . . 0 N--CA 1.405 -2.718 0 CA-C-O 121.272 0.558 . . . . 1.51 109.928 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.474 HD21 ' CE2' ' A' ' 56' ' ' TYR . 87.5 mt -93.97 130.09 40.21 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.225 -0.898 . . . . 0.8 112.076 -174.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.0 p -99.01 -173.83 2.61 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 106.478 -1.675 . . . . 0.63 106.478 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.6 m -56.72 -46.72 81.14 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 118.589 0.631 . . . . 0.61 109.866 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.27 -39.83 93.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.596 0.591 . . . . 1.65 112.596 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.14 -39.97 93.76 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 109.034 -0.728 . . . . 1.41 109.034 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.441 HD11 HD12 ' A' ' 74' ' ' LEU . 19.7 tp -66.17 -51.93 53.03 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 114.927 -1.033 . . . . 0.48 108.294 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 15' ' ' VAL . 37.7 ttm180 -46.98 -47.37 21.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.251 1.42 . . . . 2.46 111.498 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.589 ' HD2' HH22 ' A' ' 55' ' ' ARG . 29.1 ttm180 -56.39 -48.92 75.91 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.857 0.723 . . . . 3.93 110.291 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.21 -37.98 89.4 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.836 -0.62 . . . . 0.5 111.095 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.432 HD13 HG21 ' A' ' 48' ' ' THR . 4.4 mm? -62.93 -45.12 93.97 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.054 -0.351 . . . . 1.44 110.054 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 11' ' ' ARG . 85.5 t -60.0 -52.39 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 109.73 -0.47 . . . . 0.8 109.73 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.409 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.0 mt-10 -57.55 -41.82 81.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.16 -0.473 . . . . 2.05 111.677 -178.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.541 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.0 m . . . . . 0 C--N 1.315 -0.905 0 N-CA-C 112.038 0.385 . . . . 1.39 112.038 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 t70 . . . . . 0 N--CA 1.439 -0.994 0 N-CA-C 107.547 -1.279 . . . . 2.07 107.547 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.448 ' HA ' HD13 ' A' ' 33' ' ' LEU . 30.9 p90 -135.12 15.55 3.51 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.284 -0.566 . . . . 0.44 111.863 -174.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 65.0 mt -52.87 -24.86 9.97 Favored 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 116.115 1.895 . . . . 0.39 116.115 -175.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -95.21 -12.25 26.63 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.057 0.39 . . . . 2.04 111.798 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.448 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.3 mp -81.17 119.77 24.01 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.421 -0.585 . . . . 1.37 109.421 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 141.55 41.63 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.298 -1.001 . . . . 3.94 108.298 -178.194 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.5 m-85 -58.6 -37.95 76.95 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.47 0.481 . . . . 0.35 111.409 -176.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.49 -33.81 64.03 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.37 0.668 . . . . 2.79 111.364 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -82.62 -31.74 28.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.88 110.74 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.416 HG13 ' HD1' ' A' ' 40' ' ' TYR . 24.0 pt -93.16 22.52 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 N-CA-C 112.436 0.532 . . . . 0.6 112.436 -177.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.69 35.4 55.15 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.878 -0.601 . . . . 0.66 113.961 173.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 14.4 m-85 -108.24 116.9 32.82 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 112.582 0.586 . . . . 1.33 112.582 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -82.68 147.01 28.75 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 106.687 -1.597 . . . . 1.06 106.687 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 p -53.3 -35.93 60.65 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.754 1.02 . . . . 1.03 113.754 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.41 -46.93 71.75 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 109.273 -0.64 . . . . 1.56 109.273 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -61.45 -33.59 74.0 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.524 0.678 . . . . 0.43 110.33 176.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.414 ' O ' ' HB ' ' A' ' 48' ' ' THR . 51.4 tp -63.75 -51.27 65.65 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.436 -0.802 . . . . 0.43 109.95 175.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.5 mtm -63.79 -30.84 71.89 Favored 'General case' 0 C--O 1.206 -1.224 0 CA-C-N 116.36 -0.382 . . . . 1.49 111.227 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.446 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 8.5 tp10 -60.96 -37.89 83.98 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.551 1.14 . . . . 1.88 109.325 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.541 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 71.7 m -67.19 -56.7 8.83 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 113.998 -1.455 . . . . 0.45 107.953 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.525 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -56.69 -34.99 67.94 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.39 -1.277 . . . . 0.27 110.419 176.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.451 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -59.16 -41.93 89.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.303 0.641 . . . . 0.33 111.549 179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.2 mtt180 -64.86 -42.0 95.23 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.792 -0.64 . . . . 2.84 109.33 176.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 49' ' ' ALA . 91.6 mt -61.71 -41.66 97.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.239 -0.437 . . . . 0.9 110.456 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.0 mt-10 -57.13 -56.38 22.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.878 -0.601 . . . . 0.48 110.139 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 t -62.77 -50.68 70.07 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.032 -0.986 . . . . 1.19 111.374 -177.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.589 HH22 ' HD2' ' A' ' 12' ' ' ARG . 65.4 ttt180 -63.26 -44.28 95.6 Favored 'General case' 0 C--N 1.313 -0.993 0 C-N-CA 125.05 1.34 . . . . 3.07 113.301 -175.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.474 ' CE2' HD21 ' A' ' 5' ' ' LEU . 92.4 m-85 -97.07 -12.53 23.07 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.612 -0.835 . . . . 1.01 113.178 -176.054 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 56.65 2.95 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.109 -1.043 . . . . 0.93 110.594 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.473 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 12.6 p -139.51 176.3 6.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.676 -1.231 . . . . 1.16 107.676 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 58' ' ' VAL . 8.1 t -141.96 136.23 30.15 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.973 -1.121 . . . . 1.87 107.973 177.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.429 HD12 ' HB1' ' A' ' 49' ' ' ALA . 69.2 mt -124.14 126.57 25.55 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.328 -0.249 . . . . 0.57 110.328 -175.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.2 131.45 41.3 Favored 'Trans proline' 0 C--O 1.247 0.96 0 C-N-CA 122.836 2.357 . . . . 0.87 111.573 175.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.26 -40.65 64.78 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.935 1.294 . . . . 1.83 112.496 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 14.9 t70 -66.31 -40.89 90.27 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.111 -0.495 . . . . 2.34 111.002 -178.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.2 t -72.63 -40.04 61.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 109.229 -0.656 . . . . 0.66 109.229 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.3 65.82 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.528 -0.76 . . . . 0.51 111.696 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.44 11.47 39.45 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.629 -0.796 . . . . 0.61 112.506 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 11.3 tpt180 -97.14 -20.0 18.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.698 0.761 . . . . 3.98 109.841 -177.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.521 HG21 HD23 ' A' ' 74' ' ' LEU . 24.3 m -79.2 117.11 24.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-N 115.093 -0.958 . . . . 0.44 112.229 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -94.4 -39.05 10.66 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 115.506 -0.77 . . . . 1.91 110.677 175.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 47.0 p -104.65 136.91 19.11 Favored Pre-proline 0 N--CA 1.407 -2.589 0 CA-C-N 115.723 -0.671 . . . . 0.47 111.112 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.59 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.8 Cg_exo -52.17 -35.69 63.86 Favored 'Trans proline' 0 CA--C 1.516 -0.411 0 C-N-CA 124.079 3.186 . . . . 0.32 113.787 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -53.42 -42.66 67.26 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.851 0.315 . . . . 1.48 111.851 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -65.14 -46.01 82.68 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.184 0.594 . . . . 2.13 110.55 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.521 HD23 HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -65.84 -48.74 70.6 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.11 -0.95 . . . . 0.9 109.411 -178.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.01 -54.59 45.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.34 110.922 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.12 -40.61 98.11 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 112.626 0.602 . . . . 0.57 112.626 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.23 -48.65 80.5 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 108.86 -0.793 . . . . 1.96 108.86 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 65.9 mt -67.16 -35.16 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 116.074 -0.512 . . . . 0.55 110.702 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -57.41 -43.45 83.77 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 110.124 -0.324 . . . . 1.14 110.124 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.48 -40.22 97.52 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.825 -0.625 . . . . 0.53 111.919 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.5 -41.99 71.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.104 0.478 . . . . 0.6 111.032 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.32 -31.43 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 1.42 111.855 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.494 0 CA-C-O 120.966 0.412 . . . . 0.85 111.688 -179.313 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.7 mp . . . . . 0 CA--C 1.487 -1.472 0 CA-C-O 121.266 0.555 . . . . 1.51 109.813 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.528 ' H ' HD22 ' A' ' 5' ' ' LEU . 1.4 mm? -71.62 139.41 49.3 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.763 -1.108 . . . . 0.8 109.732 -176.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.7 p -97.64 -170.69 2.04 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 105.181 -2.155 . . . . 0.63 105.181 167.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.836 HG21 ' HA ' ' A' ' 29' ' ' ASP . 41.8 m -56.92 -47.54 80.37 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 119.244 0.929 . . . . 0.61 110.123 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.8 -48.36 79.94 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.977 -0.556 . . . . 1.65 112.387 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HB3' HD12 ' A' ' 5' ' ' LEU . 16.2 m-20 -66.15 -38.6 88.5 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.134 -0.484 . . . . 1.41 110.484 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.426 HD22 HD13 ' A' ' 75' ' ' LEU . 16.5 tp -66.95 -46.8 73.58 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 108.4 -0.963 . . . . 0.48 108.4 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' O ' HG23 ' A' ' 15' ' ' VAL . 41.1 ttp180 -53.54 -46.48 70.2 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 123.792 0.837 . . . . 2.46 110.858 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.5 ttt180 -54.33 -50.55 67.13 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.391 0.432 . . . . 3.93 110.251 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.42 -40.65 95.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.752 -0.658 . . . . 0.5 111.351 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.412 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 10.2 mp -64.21 -44.03 93.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.875 -0.33 . . . . 1.44 111.786 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 11' ' ' ARG . 96.9 t -60.93 -45.42 98.38 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 N-CA-C 109.928 -0.397 . . . . 0.8 109.928 178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 42.3 mt-10 -60.58 -47.52 85.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 2.05 110.955 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.539 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 38.9 m . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.642 -0.708 . . . . 1.39 112.484 -177.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.836 ' HA ' HG21 ' A' ' 7' ' ' THR . 11.5 t70 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 106.101 -1.815 . . . . 2.07 106.101 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -110.46 25.57 11.64 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.706 -0.679 . . . . 0.44 112.35 -169.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.78 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 50.6 mt -50.36 -27.75 6.84 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.061 1.874 . . . . 0.39 116.061 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -97.58 -5.19 36.18 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 118.43 0.559 . . . . 2.04 112.061 -177.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.431 HD23 HG21 ' A' ' 38' ' ' ILE . 9.4 mp -77.18 125.14 28.84 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.525 -0.734 . . . . 1.37 111.115 -177.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.442 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 10.4 mpt_? -73.74 129.62 38.29 Favored 'General case' 0 C--O 1.247 0.951 0 N-CA-C 108.438 -0.949 . . . . 3.94 108.438 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.473 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 80.6 m-85 -55.05 -50.37 69.27 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.296 0.997 . . . . 0.35 113.399 -173.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -53.51 -27.04 23.43 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 113.179 0.807 . . . . 2.79 113.179 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.78 -33.05 27.44 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.371 0.605 . . . . 0.88 110.187 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.431 HG21 HD23 ' A' ' 33' ' ' LEU . 12.6 pt -96.75 22.81 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 112.958 0.725 . . . . 0.6 112.958 -175.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.17 21.77 54.02 Favored Glycine 0 CA--C 1.506 -0.483 0 CA-C-N 115.799 -0.637 . . . . 0.66 113.997 174.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.473 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 26.6 m-85 -123.06 102.6 8.08 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 112.023 0.379 . . . . 1.33 112.023 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -82.34 147.22 28.96 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 106.914 -1.513 . . . . 1.06 106.914 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.581 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 23.8 m -50.01 -22.44 1.59 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.839 1.051 . . . . 1.03 113.839 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.57 -58.76 5.46 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.764 -0.585 . . . . 1.56 110.006 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -62.68 -26.83 68.86 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.645 0.736 . . . . 0.43 109.86 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.581 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 28.8 tp -64.28 -47.23 80.32 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 115.393 -0.821 . . . . 0.43 110.251 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.579 ' HG3' ' O ' ' A' ' 42' ' ' SER . 56.0 mtm -63.58 -33.12 74.89 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 110.051 -0.352 . . . . 1.49 110.051 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.496 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 10.9 tp10 -60.55 -37.82 82.48 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 121.957 0.884 . . . . 1.88 109.349 176.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.468 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 79.4 m -70.14 -55.98 8.03 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.319 -1.309 . . . . 0.45 107.866 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.652 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -54.9 -36.03 64.76 Favored 'General case' 0 C--O 1.203 -1.356 0 CA-C-N 114.0 -1.455 . . . . 0.27 110.809 178.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.52 83.62 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-O 121.538 0.685 . . . . 0.33 112.015 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.539 ' CZ ' ' HA ' ' A' ' 17' ' ' SER . 77.6 mtt180 -68.9 -37.83 79.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.279 -0.873 . . . . 2.84 109.599 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.652 HD12 ' HA ' ' A' ' 49' ' ' ALA . 56.8 mt -62.75 -46.32 88.6 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.903 -1.044 . . . . 0.9 109.557 176.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -55.98 -58.06 9.49 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.606 -0.725 . . . . 0.48 111.218 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.0 t -63.13 -56.37 17.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.38 -0.827 . . . . 1.19 112.284 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.548 ' HD2' ' CZ ' ' A' ' 56' ' ' TYR . 35.5 ttm180 -65.02 -43.82 91.18 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.769 0.655 . . . . 3.07 112.769 -173.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.548 ' CZ ' ' HD2' ' A' ' 55' ' ' ARG . 61.7 m-85 -98.04 -3.26 38.45 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.175 -0.61 . . . . 1.01 112.514 -173.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.62 43.42 43.87 Favored Glycine 0 C--N 1.318 -0.425 0 C-N-CA 120.645 -0.788 . . . . 0.93 112.822 176.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.416 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 11.4 p -114.91 143.15 25.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 N-CA-C 109.421 -0.585 . . . . 1.16 109.421 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 m -99.74 120.35 39.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 109.126 -0.694 . . . . 1.87 109.126 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.1 mt -126.56 107.39 23.4 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 109.434 -0.58 . . . . 0.57 109.434 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.68 141.75 97.92 Favored 'Trans proline' 0 C--O 1.242 0.691 0 C-N-CA 122.324 2.016 . . . . 0.87 110.97 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -52.2 -39.84 60.72 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.432 1.093 . . . . 1.83 112.465 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.687 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 32.8 t70 -69.01 -38.81 79.45 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.58 -0.282 . . . . 2.34 110.88 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.6 t -69.97 -38.29 74.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.897 -0.779 . . . . 0.66 108.897 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -21.42 59.03 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.58 -0.736 . . . . 0.51 111.819 176.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.3 7.74 28.69 Favored Glycine 0 N--CA 1.442 -0.941 0 C-N-CA 121.162 -0.542 . . . . 0.61 112.219 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 24.3 mmm180 -101.31 -15.55 17.22 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.541 0.686 . . . . 3.98 109.958 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.579 HG23 HD21 ' A' ' 45' ' ' LEU . 30.9 m -78.07 101.39 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-O 122.456 1.122 . . . . 0.44 109.42 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.461 ' OD2' HG23 ' A' ' 70' ' ' THR . 8.5 t70 -88.2 -25.76 22.74 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.041 -1.436 . . . . 1.91 111.262 -177.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.461 HG23 ' OD2' ' A' ' 69' ' ' ASP . 30.1 p -133.62 147.39 64.39 Favored Pre-proline 0 N--CA 1.422 -1.838 0 CA-C-N 115.432 -0.804 . . . . 0.47 108.944 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.78 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 57.1 Cg_exo -55.7 -35.77 93.8 Favored 'Trans proline' 0 C--O 1.208 -0.98 0 C-N-CA 123.302 2.668 . . . . 0.32 112.037 177.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.579 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 9.8 ptm180 -54.33 -39.8 67.4 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 123.209 0.318 . . . . 1.48 111.615 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -67.33 -48.78 66.52 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 121.544 0.688 . . . . 2.13 110.693 174.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.529 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.35 -48.19 71.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.636 -1.165 . . . . 0.9 111.682 -174.022 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' ' 5' ' ' LEU . 31.3 tp -57.02 -47.53 80.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 123.027 0.531 . . . . 0.34 109.709 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.21 -43.18 96.17 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.055 -0.975 . . . . 0.57 111.303 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.42 -48.82 79.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.793 -0.639 . . . . 1.96 109.536 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.418 ' CD1' HD13 ' A' ' 52' ' ' LEU . 49.1 mt -65.76 -43.08 93.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 N-CA-C 110.359 -0.237 . . . . 0.55 110.359 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.06 -43.01 91.67 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 120.785 -0.366 . . . . 1.14 110.445 177.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.7 -40.05 93.83 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 116.056 -0.52 . . . . 0.53 112.301 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.18 71.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.076 0.465 . . . . 0.6 110.518 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.9 mt -70.3 -16.53 63.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.083 -0.508 . . . . 1.42 112.001 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 120.865 0.364 . . . . 0.85 110.688 175.106 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.8 tp . . . . . 0 N--CA 1.389 -3.491 0 N-CA-C 109.393 -0.595 . . . . 1.51 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.445 ' O ' HD11 ' A' ' 75' ' ' LEU . 84.8 mt -106.74 126.36 52.2 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 108.901 -0.777 . . . . 0.8 108.901 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -93.42 -173.35 3.19 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.074 -1.454 . . . . 0.63 107.074 171.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.937 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.0 m -56.96 -47.14 81.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.087 -0.709 . . . . 0.61 109.087 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -58.74 -47.34 84.94 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.226 -0.897 . . . . 1.65 112.055 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -66.29 -32.29 73.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 120.652 -0.419 . . . . 1.41 110.489 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.411 HD11 ' CD1' ' A' ' 74' ' ' LEU . 17.8 tp -68.09 -46.73 70.18 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.807 -0.812 . . . . 0.48 108.807 178.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.579 ' O ' HG23 ' A' ' 15' ' ' VAL . 47.3 ttp180 -51.57 -48.39 63.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.791 -0.64 . . . . 2.46 110.574 176.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.491 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.7 ttm105 -53.39 -43.4 67.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 115.479 -0.782 . . . . 3.93 111.54 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.404 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -62.78 -40.76 98.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.032 0.444 . . . . 0.5 110.614 -179.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.46 HD12 HG21 ' A' ' 48' ' ' THR . 10.2 mp -65.95 -37.43 86.01 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.939 -0.573 . . . . 1.44 110.893 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 11' ' ' ARG . 16.5 t -71.47 -36.6 61.24 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 121.462 0.648 . . . . 0.8 109.398 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 60.3 mm-40 -64.04 -34.17 77.4 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.65 -0.657 . . . . 2.05 111.065 176.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 CA--C 1.559 1.312 0 CA-C-N 116.309 -0.405 . . . . 1.39 111.498 -177.895 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.937 ' HA ' HG21 ' A' ' 7' ' ' THR . 17.4 m-20 . . . . . 0 CA--C 1.487 -1.452 0 N-CA-C 109.821 -0.437 . . . . 2.07 109.821 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' HD13 ' A' ' 33' ' ' LEU . 18.1 p90 -112.88 9.91 18.96 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.547 -0.751 . . . . 0.44 109.98 179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.818 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 59.0 mt -52.93 -24.85 10.15 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.86 1.43 . . . . 0.39 114.86 -177.322 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -93.25 -19.94 20.91 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 120.819 0.342 . . . . 2.04 110.547 -176.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.5 mp -77.89 125.0 28.69 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 109.347 -0.612 . . . . 1.37 109.347 -176.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -74.85 135.61 41.58 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.743 -0.836 . . . . 3.94 108.743 -177.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -56.85 -46.65 81.6 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.354 0.409 . . . . 0.35 109.914 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -55.08 -28.54 53.18 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.156 0.982 . . . . 2.79 111.247 178.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -85.59 -32.83 21.88 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.812 -0.631 . . . . 0.88 111.873 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -96.26 30.4 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 113.836 1.051 . . . . 0.6 113.836 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.96 -16.78 60.6 Favored Glycine 0 C--N 1.316 -0.531 0 C-N-CA 120.587 -0.816 . . . . 0.66 113.521 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.439 ' CZ ' HD23 ' A' ' 14' ' ' LEU . 35.5 m-85 -81.61 163.93 22.22 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.718 0.771 . . . . 1.33 111.578 -177.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -135.46 140.84 45.17 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.088 -1.819 . . . . 1.06 106.088 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.486 ' O ' ' HG3' ' A' ' 46' ' ' MET . 57.6 p -48.45 -32.57 7.96 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 124.562 1.145 . . . . 1.03 113.641 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HA ' ' HE2' ' A' ' 46' ' ' MET . 6.1 tt -64.98 -50.63 65.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.482 -0.562 . . . . 1.56 109.482 177.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 -36.15 81.61 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.41 0.624 . . . . 0.43 110.293 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.545 HD21 HG23 ' A' ' 68' ' ' VAL . 61.0 tp -61.25 -37.15 82.05 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.83 -1.077 . . . . 0.43 110.54 179.084 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.0 mtm -63.1 -33.1 74.72 Favored 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 111.884 0.327 . . . . 1.49 111.884 178.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.66 -37.42 87.52 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.09 0.948 . . . . 1.88 109.468 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.46 HG21 HD12 ' A' ' 14' ' ' LEU . 31.2 m -66.94 -54.6 20.41 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.295 -1.321 . . . . 0.45 108.073 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.496 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.63 -34.81 69.71 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 114.916 -1.038 . . . . 0.27 110.044 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.94 -41.9 88.48 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 123.237 0.615 . . . . 0.33 111.322 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 mtp180 -64.93 -40.71 95.46 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 115.34 -0.845 . . . . 2.84 110.024 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.404 HD21 ' HB2' ' A' ' 13' ' ' ALA . 97.3 mt -63.96 -41.14 97.65 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.974 -0.557 . . . . 0.9 110.922 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.5 mt-10 -56.58 -55.0 39.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 123.686 0.616 . . . . 0.48 109.58 174.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -63.87 -42.44 97.51 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.097 -0.956 . . . . 1.19 111.757 -177.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -65.15 -51.91 58.35 Favored 'General case' 0 C--O 1.215 -0.725 0 C-N-CA 123.034 0.534 . . . . 3.07 111.636 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -93.68 -7.74 42.9 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 113.52 0.933 . . . . 1.01 113.52 -171.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.92 53.95 4.71 Favored Glycine 0 C--N 1.312 -0.793 0 C-N-CA 120.458 -0.877 . . . . 0.93 111.357 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.451 HG22 ' H ' ' A' ' 59' ' ' SER . 9.9 p -139.5 176.33 6.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.001 -1.111 . . . . 1.16 108.001 -177.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.451 ' H ' HG22 ' A' ' 58' ' ' VAL . 12.1 p -141.81 140.92 33.11 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 118.624 0.647 . . . . 1.87 110.422 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.496 HD12 ' HB1' ' A' ' 49' ' ' ALA . 61.2 mt -126.25 123.32 24.25 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.096 -1.076 . . . . 0.57 108.096 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.57 128.07 25.87 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.361 2.041 . . . . 0.87 110.1 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.66 -27.86 29.9 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.962 0.905 . . . . 1.83 113.355 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -67.2 -44.71 78.94 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.495 -0.557 . . . . 2.34 109.495 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.89 -41.94 60.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.852 -0.796 . . . . 0.66 108.852 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.98 -27.82 63.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.68 -0.691 . . . . 0.51 111.854 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.35 -1.51 47.49 Favored Glycine 0 N--CA 1.44 -1.087 0 C-N-CA 120.437 -0.887 . . . . 0.61 112.052 177.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -99.57 -10.55 21.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.295 0.569 . . . . 3.98 110.549 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.545 HG23 HD21 ' A' ' 45' ' ' LEU . 13.2 m -79.32 103.82 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.805 0 CA-C-O 121.582 0.706 . . . . 0.44 110.041 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.93 -40.36 14.88 Favored 'General case' 0 CA--C 1.482 -1.67 0 CA-C-N 115.523 -0.762 . . . . 1.91 110.862 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.1 p -107.86 133.03 20.62 Favored Pre-proline 0 N--CA 1.402 -2.865 0 CA-C-N 115.261 -0.881 . . . . 0.47 110.153 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.818 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.7 Cg_exo -50.71 -31.75 33.71 Favored 'Trans proline' 0 C--O 1.213 -0.755 0 C-N-CA 123.867 3.045 . . . . 0.32 113.285 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 11.5 ptp85 -52.94 -48.1 67.57 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 120.923 0.392 . . . . 1.48 110.781 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.412 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 10.5 mm-40 -66.15 -41.45 90.38 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 123.88 0.872 . . . . 2.13 110.651 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.544 HD23 HG21 ' A' ' 68' ' ' VAL . 3.0 tm? -68.26 -45.55 72.85 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.092 -0.958 . . . . 0.9 109.454 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 5' ' ' LEU . 32.3 tp -57.16 -51.9 67.45 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.724 -0.671 . . . . 0.34 109.392 178.135 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -56.65 -45.0 81.86 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.044 0.938 . . . . 0.57 112.1 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.39 -49.33 77.32 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.296 -0.631 . . . . 1.96 109.296 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.455 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 61.6 mt -66.88 -45.21 88.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 116.168 -0.469 . . . . 0.55 110.396 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -45.95 71.77 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.563 0.345 . . . . 1.14 110.671 177.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.6 -42.56 97.31 Favored Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.887 -0.597 . . . . 0.53 112.377 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.62 -38.28 80.42 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.323 0.249 . . . . 0.6 110.818 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 80.3 mt -60.79 -46.18 91.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.385 0.612 . . . . 1.42 110.28 177.47 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 115.672 -0.695 . . . . 0.85 111.548 177.733 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 tp . . . . . 0 N--CA 1.421 -1.885 0 CA-C-O 121.64 0.734 . . . . 1.51 112.075 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.08 127.07 35.99 Favored 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 114.865 -1.061 . . . . 0.8 109.827 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -101.2 179.82 4.26 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 107.07 -1.455 . . . . 0.63 107.07 170.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.885 HG21 ' HA ' ' A' ' 29' ' ' ASP . 19.4 m -58.29 -40.88 83.14 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.413 0.625 . . . . 0.61 109.594 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.39 -53.7 55.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 114.747 -1.115 . . . . 1.65 111.237 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 12' ' ' ARG . 8.5 t70 -69.6 -33.23 72.39 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 121.293 0.568 . . . . 1.41 110.395 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.493 HD11 HD12 ' A' ' 74' ' ' LEU . 17.8 tp -65.32 -45.89 82.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.158 -0.682 . . . . 0.48 109.158 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 15' ' ' VAL . 45.4 ttp180 -54.25 -43.91 71.34 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 123.937 0.895 . . . . 2.46 109.978 176.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 53.6 ttt180 -54.84 -45.82 74.54 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 115.163 -0.926 . . . . 3.93 110.726 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.478 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -61.05 -40.65 94.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.094 -0.503 . . . . 0.5 111.148 -178.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -64.78 -44.2 90.74 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 121.105 -0.238 . . . . 1.44 111.201 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 11' ' ' ARG . 60.6 t -63.19 -47.95 89.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.284 -0.416 . . . . 0.8 110.019 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.04 -32.17 73.47 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.832 0.308 . . . . 2.05 111.832 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.497 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 35.7 t . . . . . 0 C--N 1.313 -0.989 0 CA-C-O 120.773 0.321 . . . . 1.39 111.395 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.885 ' HA ' HG21 ' A' ' 7' ' ' THR . 4.2 m-20 . . . . . 0 CA--C 1.49 -1.359 0 CA-C-O 121.319 0.581 . . . . 2.07 110.638 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.447 ' HA ' HD23 ' A' ' 33' ' ' LEU . 21.7 p90 -95.35 13.26 26.31 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.391 -0.822 . . . . 0.44 110.144 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.725 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 58.6 mt -50.82 -23.95 3.14 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.82 1.785 . . . . 0.39 115.82 -175.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.98 -8.93 32.39 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.39 0.614 . . . . 2.04 111.414 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 30' ' ' PHE . 3.9 mm? -79.12 123.72 27.63 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.612 -0.514 . . . . 1.37 109.612 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -75.48 141.52 43.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.175 -1.046 . . . . 3.94 108.175 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.6 m-85 -59.99 -41.38 91.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 110.278 -0.268 . . . . 0.35 110.278 -178.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -57.76 -27.37 62.99 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.355 0.597 . . . . 2.79 111.344 176.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -84.79 -33.96 22.88 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.094 0.473 . . . . 0.88 110.895 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.2 pt -93.15 16.91 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.634 0.605 . . . . 0.6 112.634 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.79 43.18 18.84 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 116.059 -0.519 . . . . 0.66 113.411 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.423 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 15.2 m-85 -126.93 117.09 21.84 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 122.684 -0.304 . . . . 1.33 111.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.43 151.85 24.39 Favored 'General case' 0 CA--C 1.474 -1.956 0 N-CA-C 108.269 -1.011 . . . . 1.06 108.269 171.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.466 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 15.7 p -53.45 -30.35 40.15 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.616 0.969 . . . . 1.03 113.616 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.76 -54.59 36.84 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.625 -0.88 . . . . 1.56 108.625 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.06 80.16 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.053 0.541 . . . . 0.43 111.064 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.516 ' O ' ' HB ' ' A' ' 48' ' ' THR . 65.0 tp -64.3 -41.07 97.04 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.907 -0.588 . . . . 0.43 110.912 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 71.4 mtm -64.28 -31.73 73.05 Favored 'General case' 0 C--O 1.196 -1.723 0 O-C-N 122.026 -0.422 . . . . 1.49 111.541 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 9.3 tp10 -63.58 -33.03 74.7 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.731 0.777 . . . . 1.88 109.237 174.039 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 39.7 m -66.4 -55.32 16.36 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.398 -1.334 . . . . 0.45 107.398 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.06 -39.69 75.41 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-N 114.345 -1.298 . . . . 0.27 109.888 175.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.25 -45.98 86.79 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 123.775 0.83 . . . . 0.33 111.95 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 56.4 mtt180 -65.03 -37.15 86.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.707 -0.679 . . . . 2.84 109.908 178.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 13' ' ' ALA . 81.3 mt -65.59 -38.94 90.93 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 116.049 -0.523 . . . . 0.9 111.039 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.6 mt-10 -56.6 -55.08 38.5 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.626 0.579 . . . . 0.48 109.482 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 m -62.07 -40.61 96.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.518 -0.764 . . . . 1.19 112.136 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -66.09 -49.46 67.52 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.124 -0.489 . . . . 3.07 112.14 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -98.51 -11.16 22.54 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.947 1.462 . . . . 1.01 114.947 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.74 53.08 6.66 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.415 -0.898 . . . . 0.93 111.188 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.6 p -135.24 137.49 50.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 0 N-CA-C 108.448 -0.945 . . . . 1.16 108.448 -177.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.4 m -96.57 114.54 26.21 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 120.722 0.296 . . . . 1.87 110.7 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.2 mt -104.62 122.24 44.28 Favored Pre-proline 0 C--N 1.32 -0.695 0 C-N-CA 122.931 0.492 . . . . 0.57 109.969 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -67.78 131.73 24.95 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.956 2.437 . . . . 0.87 112.07 178.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -52.06 -40.51 61.26 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.848 1.259 . . . . 1.83 113.742 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.44 -37.85 83.63 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.901 -0.32 . . . . 2.34 110.533 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 34.0 t -75.23 -42.01 44.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.891 -0.781 . . . . 0.66 108.891 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.88 -32.05 69.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.603 -0.726 . . . . 0.51 111.386 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.87 9.68 63.97 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.73 -0.748 . . . . 0.61 112.273 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -100.41 -24.13 14.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.952 0.406 . . . . 3.98 110.292 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.536 HG21 HD23 ' A' ' 74' ' ' LEU . 20.8 m -75.68 103.88 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 CA-C-O 122.029 0.918 . . . . 0.44 111.032 -177.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.74 -30.32 20.4 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-N 115.132 -0.94 . . . . 1.91 111.488 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.4 p -122.51 145.53 45.04 Favored Pre-proline 0 N--CA 1.419 -1.981 0 CA-C-N 115.946 -0.57 . . . . 0.47 109.836 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.725 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.4 Cg_exo -53.07 -40.73 75.77 Favored 'Trans proline' 0 CA--C 1.509 -0.773 0 C-N-CA 124.023 3.148 . . . . 0.32 114.024 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.9 ptp85 -52.36 -39.78 61.17 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 123.495 0.497 . . . . 1.48 111.663 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.22 -51.55 63.15 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.933 -0.576 . . . . 2.13 109.837 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.536 HD23 HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -67.34 -39.76 85.83 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.619 -1.173 . . . . 0.9 110.213 -176.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.433 HD13 HD22 ' A' ' 10' ' ' LEU . 48.0 tp -56.91 -57.67 11.5 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 109.219 -0.659 . . . . 0.34 109.219 177.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.87 -37.86 74.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 123.766 0.666 . . . . 0.57 111.438 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -59.57 -53.08 62.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.682 -0.69 . . . . 1.96 110.439 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.465 HG22 HD13 ' A' ' 82' ' ' LEU . 44.9 mt -76.08 -21.92 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 C-N-CA 120.364 -0.534 . . . . 0.55 110.53 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -64.83 -50.29 67.28 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.853 -0.795 . . . . 1.14 108.853 173.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.66 -38.24 95.41 Favored Glycine 0 N--CA 1.439 -1.125 0 CA-C-N 115.249 -0.887 . . . . 0.53 111.668 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.75 -39.11 84.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.433 0.159 . . . . 0.6 110.845 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.465 HD13 HG22 ' A' ' 78' ' ' ILE . 5.3 mp -70.86 -39.01 73.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 122.357 0.263 . . . . 1.42 111.4 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.479 0 CA-C-O 121.567 0.698 . . . . 0.85 110.019 175.582 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.522 ' HA ' ' HG ' ' A' ' 82' ' ' LEU . 22.6 tp . . . . . 0 N--CA 1.418 -2.034 0 N-CA-C 103.616 -2.735 . . . . 1.51 103.616 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.546 HD11 HD22 ' A' ' 52' ' ' LEU . 94.9 mt -117.35 124.22 48.39 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 108.157 -1.053 . . . . 0.8 108.157 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.9 p -97.6 -171.38 2.17 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 107.836 -1.172 . . . . 0.63 107.836 170.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.1 m -52.25 -54.98 24.33 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 123.891 0.876 . . . . 0.61 111.436 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.444 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . 32.1 t70 -72.07 -28.13 63.13 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 112.713 0.634 . . . . 1.65 112.713 -178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.47 -44.98 85.45 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.573 -0.899 . . . . 1.41 108.573 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 30.9 tp -65.68 -47.39 75.63 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.626 -1.17 . . . . 0.48 108.881 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 36.7 ttt-85 -49.54 -51.51 36.13 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.343 1.057 . . . . 2.46 110.963 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 65.6 ttt180 -59.08 -50.58 73.54 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.435 -0.348 . . . . 3.93 111.581 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.26 -36.22 77.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.13 -0.486 . . . . 0.5 111.323 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.624 HD23 HG21 ' A' ' 48' ' ' THR . 99.1 mt -63.34 -53.52 51.37 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.523 0.514 . . . . 1.44 110.169 177.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 94.6 t -57.97 -45.92 87.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.949 -0.569 . . . . 0.8 111.355 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.624 ' HB2' HH12 ' A' ' 51' ' ' ARG . 55.6 mt-10 -60.87 -30.46 70.15 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.503 -0.317 . . . . 2.05 111.723 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 C--N 1.319 -0.724 0 C-N-CA 121.128 -0.229 . . . . 1.39 111.428 -176.435 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 CA--C 1.502 -0.895 0 N-CA-C 109.264 -0.643 . . . . 2.07 109.264 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -100.36 3.66 43.43 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.921 -0.77 . . . . 0.44 108.921 176.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.692 HD13 ' HB3' ' A' ' 72' ' ' ARG . 41.4 mt -54.2 -26.68 29.59 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.541 1.136 . . . . 0.39 113.99 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -90.32 -19.31 24.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.733 0.778 . . . . 2.04 110.445 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -81.96 123.71 29.12 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.317 -0.994 . . . . 1.37 108.317 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.63 146.0 42.79 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 116.278 -0.419 . . . . 3.94 110.292 -176.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.543 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 70.2 m-85 -61.94 -32.91 73.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.342 0.591 . . . . 0.35 109.543 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -54.72 -40.68 69.48 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.739 -1.119 . . . . 2.79 110.182 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -81.1 -33.34 33.39 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.941 -1.027 . . . . 0.88 111.06 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.5 pt -92.14 19.55 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 112.26 0.467 . . . . 0.6 112.26 -177.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 69.34 46.33 57.15 Favored Glycine 0 CA--C 1.511 -0.177 0 CA-C-N 116.122 -0.49 . . . . 0.66 113.626 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.543 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 7.7 m-85 -118.86 124.89 48.25 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 120.724 0.297 . . . . 1.33 111.502 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -84.7 134.1 34.36 Favored 'General case' 0 CA--C 1.484 -1.572 0 N-CA-C 107.709 -1.219 . . . . 1.06 107.709 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.505 ' O ' ' HB3' ' A' ' 45' ' ' LEU . 15.9 m -53.63 -26.12 20.72 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 123.607 0.567 . . . . 1.03 111.418 174.001 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.7 tp -64.7 -49.89 69.13 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.78 -0.575 . . . . 1.56 110.099 174.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.86 73.28 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 122.128 0.966 . . . . 0.43 109.702 177.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.624 HD21 HG23 ' A' ' 68' ' ' VAL . 33.8 tp -62.77 -50.64 70.23 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.49 -1.232 . . . . 0.43 108.957 176.446 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.9 mtp -62.56 -33.29 74.66 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.264 -0.425 . . . . 1.49 110.823 176.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.71 -36.59 81.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 122.159 0.981 . . . . 1.88 108.757 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.624 HG21 HD23 ' A' ' 14' ' ' LEU . 89.3 m -68.57 -57.65 5.44 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.245 -1.391 . . . . 0.45 107.245 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.619 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -54.82 -33.02 61.08 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.908 -1.496 . . . . 0.27 111.07 178.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.65 -46.92 83.57 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.154 0.502 . . . . 0.33 111.567 178.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.624 HH12 ' HB2' ' A' ' 16' ' ' GLU . 66.7 mtp180 -64.07 -37.79 88.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.307 -0.861 . . . . 2.84 109.634 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.619 HD12 ' HA ' ' A' ' 49' ' ' ALA . 65.1 mt -66.14 -47.97 72.31 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.9 110.295 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.9 mt-10 -58.43 -40.58 82.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.903 0.383 . . . . 0.48 110.246 175.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.8 t -61.26 -64.39 0.97 Allowed 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.203 -0.908 . . . . 1.19 111.005 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -63.86 -41.67 97.72 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.354 0.872 . . . . 3.07 113.354 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -93.2 -4.5 51.9 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 112.999 0.741 . . . . 1.01 112.999 -171.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.86 26.06 72.07 Favored Glycine 0 C--O 1.239 0.456 0 C-N-CA 120.981 -0.628 . . . . 0.93 112.562 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.777 HG11 HD22 ' A' ' 82' ' ' LEU . 28.9 m -99.15 173.96 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.937 -0.132 . . . . 1.16 110.749 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.2 p -141.9 113.68 7.91 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-O 121.421 0.629 . . . . 1.87 112.05 -176.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.488 HD12 ' HB1' ' A' ' 49' ' ' ALA . 63.4 mt -103.92 127.29 29.65 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 108.509 -0.923 . . . . 0.57 108.509 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.72 136.66 68.04 Favored 'Trans proline' 0 C--O 1.242 0.681 0 C-N-CA 122.37 2.047 . . . . 0.87 110.645 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -52.72 -41.87 64.35 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.902 0.704 . . . . 1.83 112.902 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.28 -32.51 72.72 Favored 'General case' 0 C--O 1.183 -2.429 0 CA-C-N 116.481 -0.327 . . . . 2.34 110.447 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.6 -44.74 46.6 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 N-CA-C 109.093 -0.706 . . . . 0.66 109.093 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.04 -35.37 66.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.531 0.732 . . . . 0.51 112.516 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.54 23.08 27.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.538 -0.839 . . . . 0.61 112.967 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -134.87 -0.28 2.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.8 0.81 . . . . 3.98 110.451 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.624 HG23 HD21 ' A' ' 45' ' ' LEU . 6.3 m -78.5 101.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.268 -1.012 . . . . 0.44 108.268 173.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -89.96 -30.52 17.75 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 114.49 -1.232 . . . . 1.91 110.295 -173.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.4 p -114.85 130.61 24.01 Favored Pre-proline 0 N--CA 1.403 -2.788 0 CA-C-N 115.085 -0.962 . . . . 0.47 109.914 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.645 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 86.4 Cg_exo -47.91 -46.74 20.85 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.095 3.197 . . . . 0.32 113.738 -175.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.692 ' HB3' HD13 ' A' ' 31' ' ' LEU . 18.2 ptt180 -54.33 -37.28 64.69 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 114.155 1.169 . . . . 1.48 114.155 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -66.54 -43.56 84.8 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.159 0.504 . . . . 2.13 110.976 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.486 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 3.2 tm? -69.22 -45.07 70.73 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.203 -0.908 . . . . 0.9 109.398 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.6 tp -56.31 -49.79 73.3 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 123.454 0.702 . . . . 0.34 109.411 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -57.23 -46.11 83.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.166 -0.925 . . . . 0.57 111.503 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -61.05 -47.12 87.83 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.241 -0.651 . . . . 1.96 109.241 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.492 HG21 HD12 ' A' ' 5' ' ' LEU . 58.3 mt -70.3 -27.98 33.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.795 0.331 . . . . 0.55 111.563 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -39.23 83.91 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 121.922 -0.486 . . . . 1.14 110.032 174.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.51 -39.58 91.09 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.772 -0.931 . . . . 0.53 110.772 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.28 87.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.677 0.275 . . . . 0.6 110.503 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.777 HD22 HG11 ' A' ' 58' ' ' VAL . 4.0 mm? -69.74 -27.57 65.06 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 111.878 0.325 . . . . 1.42 111.878 176.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.748 0 CA-C-O 121.471 0.653 . . . . 0.85 109.483 174.814 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB3' ' OD1' ' A' ' 79' ' ' ASN . 9.1 mp . . . . . 0 N--CA 1.44 -0.945 0 CA-C-O 121.819 0.819 . . . . 1.51 112.218 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.463 HD11 ' CD1' ' A' ' 52' ' ' LEU . 38.6 mt -96.05 142.69 27.95 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.16 -0.927 . . . . 0.8 112.329 -167.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.8 p -101.99 -178.15 3.62 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.451 -1.685 . . . . 0.63 106.451 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.866 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.4 m -59.88 -32.92 71.17 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.315 0.578 . . . . 0.61 110.081 175.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.588 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 15.7 t70 -67.82 -42.76 81.0 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.627 -0.715 . . . . 1.65 110.043 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.419 ' HB3' HD22 ' A' ' 5' ' ' LEU . 6.9 m-20 -63.92 -38.29 90.53 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.55 -0.75 . . . . 1.41 109.476 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.4 tp -66.32 -45.68 79.46 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.182 -0.917 . . . . 0.48 109.844 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttp180 -52.41 -46.27 66.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.762 0.425 . . . . 2.46 111.024 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 94.4 mtt180 -54.66 -50.1 69.0 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.531 -0.759 . . . . 3.93 110.187 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.15 87.32 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.402 -0.817 . . . . 0.5 111.841 -175.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.02 -45.74 80.41 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.159 -0.216 . . . . 1.44 110.667 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.3 t -57.09 -40.33 72.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.151 0.5 . . . . 0.8 110.052 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 70.1 mm-40 -60.53 -40.08 90.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.741 -0.663 . . . . 2.05 111.408 177.56 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.31 -1.145 0 CA-C-N 115.492 -0.776 . . . . 1.39 112.162 -174.195 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.866 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.4 t70 . . . . . 0 N--CA 1.43 -1.44 0 N-CA-C 109.104 -0.702 . . . . 2.07 109.104 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.463 ' HA ' HD23 ' A' ' 33' ' ' LEU . 28.2 p90 -105.4 19.4 20.64 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 116.049 -0.523 . . . . 0.44 111.161 -177.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.857 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 57.9 mt -52.19 -22.9 4.75 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.95 1.463 . . . . 0.39 114.95 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.97 -20.42 19.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.654 0.264 . . . . 2.04 111.513 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 30' ' ' PHE . 3.4 mm? -78.48 114.1 17.09 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-O 121.453 0.644 . . . . 1.37 109.587 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.596 ' HG2' HG22 ' A' ' 70' ' ' THR . 40.1 mtt180 -76.35 144.04 40.39 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.718 -1.128 . . . . 3.94 109.978 -172.028 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.597 ' HA ' HG12 ' A' ' 38' ' ' ILE . 44.1 m-85 -61.78 -41.9 98.3 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.369 -0.378 . . . . 0.35 110.993 -174.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -37.5 70.43 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.725 0.774 . . . . 2.79 110.338 176.075 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -81.09 -23.59 38.32 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.247 -0.888 . . . . 0.88 110.963 -174.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.597 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.2 pt -98.22 15.55 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.408 0.623 . . . . 0.6 111.788 177.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.32 36.9 38.06 Favored Glycine 0 C--O 1.226 -0.377 0 CA-C-N 115.823 -0.626 . . . . 0.66 113.967 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -113.0 127.58 56.27 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 122.305 -0.527 . . . . 1.33 111.356 177.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -86.05 145.37 27.1 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 106.304 -1.739 . . . . 1.06 106.304 172.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 46' ' ' MET . 34.1 p -52.55 -31.37 35.5 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 113.275 0.843 . . . . 1.03 113.275 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.69 -43.16 90.09 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.007 0.432 . . . . 1.56 110.108 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.415 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -64.32 -36.38 83.94 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 121.375 0.607 . . . . 0.43 109.392 175.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.556 ' O ' ' HB ' ' A' ' 48' ' ' THR . 50.6 tp -66.39 -40.14 89.49 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.3 -0.863 . . . . 0.43 111.621 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.533 ' HG3' ' O ' ' A' ' 42' ' ' SER . 60.6 mtt -64.5 -30.19 71.23 Favored 'General case' 0 C--O 1.207 -1.141 0 O-C-N 121.714 -0.616 . . . . 1.49 110.444 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 7.7 tp10 -61.65 -33.59 74.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 122.282 1.039 . . . . 1.88 108.742 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.556 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 55.8 m -67.92 -61.65 1.77 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.583 -1.644 . . . . 0.45 107.362 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -54.05 -34.54 60.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.319 -1.309 . . . . 0.27 111.026 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.15 -49.72 73.17 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 123.651 0.78 . . . . 0.33 111.896 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HA ' ' OG ' ' A' ' 54' ' ' SER . 92.8 mtt180 -67.3 -30.48 70.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.821 -0.627 . . . . 2.84 111.375 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 48' ' ' THR . 3.9 mm? -64.53 -46.59 82.23 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.47 -0.332 . . . . 0.9 110.198 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.582 ' HA ' HG12 ' A' ' 58' ' ' VAL . 44.4 mt-10 -57.09 -51.38 69.53 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 115.562 -0.745 . . . . 0.48 110.358 177.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.431 ' OG ' ' HA ' ' A' ' 51' ' ' ARG . 6.4 p -63.45 -52.46 61.34 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.501 0.926 . . . . 1.19 113.501 -178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.483 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 30.3 ttm180 -66.46 -49.84 65.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.809 0.67 . . . . 3.07 112.809 -177.096 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.483 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 99.6 m-85 -92.56 -17.36 24.53 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.056 0.762 . . . . 1.01 113.056 -170.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.15 68.14 1.44 Allowed Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.243 -0.979 . . . . 0.93 110.945 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 53' ' ' GLU . 10.8 p -141.61 176.1 4.64 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 N-CA-C 108.066 -1.087 . . . . 1.16 108.066 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.501 ' H ' HG22 ' A' ' 58' ' ' VAL . 4.4 p -140.68 107.36 5.35 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.345 0.593 . . . . 1.87 109.996 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.445 HD12 ' HB1' ' A' ' 49' ' ' ALA . 61.6 mt -105.99 111.81 64.38 Favored Pre-proline 0 C--N 1.31 -1.109 0 CA-C-N 115.227 -0.897 . . . . 0.57 109.197 -176.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -59.58 130.13 34.06 Favored 'Trans proline' 0 C--O 1.25 1.076 0 C-N-CA 122.629 2.22 . . . . 0.87 111.515 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -51.18 -39.46 56.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.306 1.442 . . . . 1.83 111.961 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.42 -39.02 85.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.496 -0.32 . . . . 2.34 111.292 -177.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.22 -39.54 42.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 109.041 -0.726 . . . . 0.66 109.041 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -36.69 73.88 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.904 -0.589 . . . . 0.51 111.096 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -88.65 4.83 85.08 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.015 -0.612 . . . . 0.61 112.349 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -102.78 -25.21 13.6 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 122.779 -0.248 . . . . 3.98 111.271 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 m -72.71 105.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.835 0.826 . . . . 0.44 109.933 -178.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.441 ' OD2' ' HD3' ' A' ' 34' ' ' ARG . 34.1 t70 -87.44 -24.28 24.21 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 114.722 -1.126 . . . . 1.91 110.807 -176.295 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.596 HG22 ' HG2' ' A' ' 34' ' ' ARG . 31.9 p -123.96 138.93 31.44 Favored Pre-proline 0 N--CA 1.418 -2.053 0 CA-C-N 115.685 -0.689 . . . . 0.47 110.705 -178.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.857 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.2 Cg_exo -54.73 -34.16 83.23 Favored 'Trans proline' 0 CA--C 1.514 -0.509 0 C-N-CA 123.669 2.913 . . . . 0.32 112.812 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.414 ' HG2' ' HB ' ' A' ' 70' ' ' THR . 3.9 ptp180 -51.8 -45.21 63.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 123.413 0.446 . . . . 1.48 111.966 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.38 -45.32 88.19 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 121.29 0.567 . . . . 2.13 110.483 178.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.05 -46.2 75.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.328 -0.851 . . . . 0.9 109.88 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.42 -46.08 83.93 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 116.216 -0.447 . . . . 0.34 109.803 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.11 -43.34 98.7 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.189 -0.914 . . . . 0.57 110.546 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.58 -52.28 66.08 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 123.568 0.747 . . . . 1.96 111.301 -177.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.7 mt -68.2 -46.62 80.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.558 0 C-N-CA 120.234 -0.586 . . . . 0.55 110.62 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.442 ' OD1' ' HB3' ' A' ' 4' ' ' LEU . 17.1 m-80 -55.99 -42.54 76.51 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 120.61 0.243 . . . . 1.14 110.575 177.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.12 -46.38 65.69 Favored Glycine 0 C--N 1.321 -0.304 0 CA-C-N 116.303 -0.408 . . . . 0.53 112.624 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.24 -35.91 80.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.705 0.288 . . . . 0.6 110.565 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.06 -39.45 79.12 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.376 -0.374 . . . . 1.42 111.138 176.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.233 -0.44 . . . . 0.85 110.669 177.816 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 79' ' ' ASN . 25.7 tp . . . . . 0 N--CA 1.398 -3.031 0 CA-C-O 121.093 0.473 . . . . 1.51 109.805 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.7 mt -92.52 128.48 38.39 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-N 115.855 -0.611 . . . . 0.8 111.051 -176.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.6 p -97.8 -176.35 3.44 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.409 -1.7 . . . . 0.63 106.409 168.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.4 m -57.81 -36.19 71.88 Favored 'General case' 0 C--N 1.312 -1.022 0 O-C-N 123.039 0.212 . . . . 0.61 110.626 174.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 11' ' ' ARG . 25.6 t70 -78.53 -32.71 48.09 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.076 0.465 . . . . 1.65 111.069 -177.301 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.46 -42.78 87.07 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.97 -0.752 . . . . 1.41 108.97 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.697 HD11 HD22 ' A' ' 74' ' ' LEU . 13.9 tp -66.54 -41.69 88.34 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.729 -1.123 . . . . 0.48 108.667 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 8' ' ' ASP . 72.6 ttt180 -48.32 -58.48 4.53 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.203 1.401 . . . . 2.46 111.601 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.54 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 62.3 mtp180 -58.18 -36.44 73.06 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 112.498 0.555 . . . . 3.93 112.498 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -45.2 95.3 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 123.377 0.423 . . . . 0.5 109.905 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.93 -42.36 90.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.344 -0.389 . . . . 1.44 111.799 177.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 11' ' ' ARG . 90.6 t -54.54 -51.71 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 121.029 0.442 . . . . 0.8 110.221 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 13.7 mm-40 -63.72 -32.61 74.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.505 -0.77 . . . . 2.05 112.522 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p . . . . . 0 C--N 1.317 -0.836 0 N-CA-C 112.745 0.646 . . . . 1.39 112.745 -175.544 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 . . . . . 0 CA--C 1.499 -0.994 0 N-CA-C 109.925 -0.398 . . . . 2.07 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' A' ' 33' ' ' LEU . 14.0 p90 -136.4 15.16 3.21 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.261 0.553 . . . . 0.44 110.075 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.644 HD23 ' HB2' ' A' ' 71' ' ' PRO . 60.1 mt -53.48 -24.16 12.25 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.183 1.549 . . . . 0.39 115.183 -177.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -95.36 -3.34 47.35 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.387 0.514 . . . . 2.04 112.387 -178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.498 ' O ' ' HD3' ' A' ' 71' ' ' PRO . 8.9 mp -80.63 138.81 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.394 -0.367 . . . . 1.37 110.698 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.11 141.37 35.83 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 109.785 -0.45 . . . . 3.94 109.785 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.433 ' HA ' HG12 ' A' ' 38' ' ' ILE . 50.4 m-85 -68.27 -42.91 78.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.362 0.601 . . . . 0.35 109.468 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.537 ' CD ' ' H ' ' A' ' 36' ' ' GLU . 1.5 mp0 -54.67 -34.96 63.04 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 124.655 1.182 . . . . 2.79 109.921 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -79.32 -31.39 43.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.564 -1.198 . . . . 0.88 111.124 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.54 HG13 ' CD1' ' A' ' 40' ' ' TYR . 31.0 pt -93.21 15.78 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 120.485 -0.486 . . . . 0.6 111.572 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.19 34.36 17.76 Favored Glycine 0 C--O 1.238 0.382 0 CA-C-N 115.732 -0.667 . . . . 0.66 114.127 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.54 ' CD1' HG13 ' A' ' 38' ' ' ILE . 9.1 m-85 -116.45 123.16 46.82 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 122.598 -0.354 . . . . 1.33 111.264 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.09 151.16 24.35 Favored 'General case' 0 CA--C 1.48 -1.726 0 N-CA-C 106.439 -1.689 . . . . 1.06 106.439 171.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.3 p -53.51 -34.63 58.81 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 113.076 0.769 . . . . 1.03 113.076 179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.71 -45.95 77.1 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 109.307 -0.627 . . . . 1.56 109.307 177.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.78 94.9 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.474 0.654 . . . . 0.43 109.846 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.606 HD21 HG23 ' A' ' 68' ' ' VAL . 56.7 tp -62.19 -40.16 95.15 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.686 -1.143 . . . . 0.43 110.175 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 81.9 mtp -63.99 -33.15 75.09 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.213 -0.449 . . . . 1.49 111.489 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.91 -29.3 70.23 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.492 0.663 . . . . 1.88 109.995 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 24.7 m -64.8 -61.86 1.92 Allowed 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.912 -1.514 . . . . 0.45 106.912 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.2 -36.06 70.39 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.776 -1.556 . . . . 0.27 110.655 177.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.5 -45.9 87.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.19 0.596 . . . . 0.33 111.96 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.53 -37.52 86.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.852 -0.613 . . . . 2.84 110.222 177.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 96.7 mt -64.38 -43.08 95.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.194 -0.457 . . . . 0.9 110.667 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 40.4 mt-10 -57.0 -54.05 51.16 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 109.936 -0.394 . . . . 0.48 109.936 175.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.4 m -61.55 -39.7 92.05 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.912 -1.04 . . . . 1.19 111.783 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.505 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 32.1 ttm180 -67.53 -50.55 58.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.27 -0.423 . . . . 3.07 111.733 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.505 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 89.9 m-85 -96.92 -22.91 16.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.691 1.367 . . . . 1.01 114.691 -171.195 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.63 21.66 33.58 Favored Glycine 0 C--N 1.306 -1.113 0 C-N-CA 119.937 -1.125 . . . . 0.93 112.461 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.02 137.41 26.55 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 N-CA-C 108.645 -0.872 . . . . 1.16 108.645 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.0 m -98.34 113.23 25.13 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.044 0.449 . . . . 1.87 110.866 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.6 mt -99.35 125.24 41.94 Favored Pre-proline 0 C--N 1.31 -1.125 0 CA-C-N 116.251 -0.432 . . . . 0.57 110.026 -178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.415 ' HB2' HG23 ' A' ' 64' ' ' VAL . 36.5 Cg_exo -62.77 116.01 3.28 Favored 'Trans proline' 0 C--O 1.243 0.74 0 C-N-CA 122.2 1.933 . . . . 0.87 110.044 175.13 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -55.24 -24.25 26.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.92 0.888 . . . . 1.83 113.059 -177.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.84 -43.94 74.47 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.175 0.512 . . . . 2.34 110.007 176.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 61' ' ' PRO . 32.6 t -74.55 -34.71 36.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 109.142 -0.688 . . . . 0.66 109.142 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.7 -24.5 61.52 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.726 -0.67 . . . . 0.51 111.976 178.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -0.11 48.36 Favored Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.548 -0.834 . . . . 0.61 112.449 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -100.62 -12.81 18.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.184 0.516 . . . . 3.98 110.606 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.606 HG23 HD21 ' A' ' 45' ' ' LEU . 19.0 m -74.04 115.96 15.84 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.296 0 CA-C-O 121.635 0.731 . . . . 0.44 110.576 -177.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.98 -49.85 6.53 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 114.637 -1.165 . . . . 1.91 109.701 -176.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.528 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 26.5 p -118.15 157.31 49.18 Favored Pre-proline 0 N--CA 1.406 -2.671 0 CA-C-N 114.775 -1.102 . . . . 0.47 109.314 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.644 ' HB2' HD23 ' A' ' 31' ' ' LEU . 49.2 Cg_exo -58.49 -27.28 81.59 Favored 'Trans proline' 0 CA--C 1.5 -1.202 0 C-N-CA 123.591 2.861 . . . . 0.32 112.657 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -52.97 -48.64 67.27 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.602 0.564 . . . . 1.48 110.002 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.68 -47.61 80.53 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 114.626 -1.17 . . . . 2.13 109.828 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -67.19 -50.27 61.6 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.853 -1.067 . . . . 0.9 110.144 -175.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' A' ' 79' ' ' ASN . 59.7 tp -55.85 -52.1 65.2 Favored 'General case' 0 C--O 1.206 -1.198 0 O-C-N 123.61 0.569 . . . . 0.34 110.389 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.04 -37.3 82.13 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 123.69 0.619 . . . . 0.57 112.03 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.98 -52.27 64.68 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.314 -0.403 . . . . 1.96 109.945 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.7 mt -70.67 -44.49 76.51 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.902 0 C-N-CA 120.223 -0.591 . . . . 0.55 109.932 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.48 ' HA ' HD11 ' A' ' 4' ' ' LEU . 6.7 t-20 -49.52 -53.59 22.62 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 123.735 0.814 . . . . 1.14 110.755 -175.38 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.84 94.67 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.985 -0.626 . . . . 0.53 112.696 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.72 -33.94 73.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.12 0.486 . . . . 0.6 111.607 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.414 HD23 HD12 ' A' ' 4' ' ' LEU . 26.3 tp -78.68 -31.91 46.86 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 123.835 0.854 . . . . 1.42 110.051 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 121.569 0.7 . . . . 0.85 109.764 173.974 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.501 HD11 ' HA ' ' A' ' 79' ' ' ASN . 46.4 tp . . . . . 0 N--CA 1.402 -2.848 0 N-CA-C 107.326 -1.361 . . . . 1.51 107.326 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.405 HD11 HD22 ' A' ' 52' ' ' LEU . 96.0 mt -84.11 122.45 28.83 Favored 'General case' 0 C--N 1.289 -2.056 0 C-N-CA 120.422 -0.511 . . . . 0.8 109.8 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.4 p -102.1 -173.92 2.45 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.239 -1.393 . . . . 0.63 107.239 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.9 m -58.36 -43.3 88.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.75 -0.833 . . . . 0.61 108.75 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.9 -47.1 87.96 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.76 -1.109 . . . . 1.65 110.943 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.27 -39.02 89.14 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 116.091 -0.504 . . . . 1.41 110.771 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.436 HD11 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -66.03 -41.59 90.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 0.48 110.02 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -53.31 -54.73 32.19 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.878 0.871 . . . . 2.46 109.634 175.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -58.72 -38.85 79.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.491 -1.231 . . . . 3.93 111.42 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.96 82.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.08 -0.509 . . . . 0.5 111.536 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.74 HD23 HG21 ' A' ' 48' ' ' THR . 94.8 mt -63.67 -44.58 93.32 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.219 0.533 . . . . 1.44 109.97 178.2 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.0 t -62.77 -50.62 79.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.395 -0.82 . . . . 0.8 109.103 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -59.72 -25.05 64.5 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 2.05 113.167 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.631 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 27.5 m . . . . . 0 C--N 1.301 -1.537 0 CA-C-O 120.81 0.338 . . . . 1.39 111.721 -178.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 CA--C 1.498 -1.035 0 N-CA-C 108.85 -0.796 . . . . 2.07 108.85 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.433 ' HA ' HD13 ' A' ' 33' ' ' LEU . 19.6 p90 -108.96 12.55 25.26 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 120.198 -0.601 . . . . 0.44 110.734 -178.06 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.568 HD23 ' HB2' ' A' ' 71' ' ' PRO . 57.2 mt -51.45 -28.63 13.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.834 1.79 . . . . 0.39 115.834 -176.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -96.73 -6.79 35.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.489 0.661 . . . . 2.04 111.534 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.9 mp -79.82 129.68 34.69 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 121.875 -0.516 . . . . 1.37 110.122 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.76 137.78 39.51 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 109.455 -0.572 . . . . 3.94 109.455 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -58.54 -49.72 76.38 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 123.69 0.619 . . . . 0.35 110.23 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -57.28 -27.37 62.06 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.466 0.479 . . . . 2.79 111.697 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -81.74 -32.22 31.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.752 0.31 . . . . 0.88 110.315 -176.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.5 pt -93.72 23.18 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 112.224 0.453 . . . . 0.6 112.224 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 78.44 14.88 81.69 Favored Glycine 0 C--O 1.24 0.507 0 C-N-CA 121.118 -0.563 . . . . 0.66 113.855 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -103.36 125.77 50.16 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.007 0.432 . . . . 1.33 111.097 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -87.46 138.48 31.44 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 108.195 -1.039 . . . . 1.06 108.195 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.3 p -51.4 -33.09 28.74 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 123.718 0.636 . . . . 1.03 112.33 173.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.77 -48.66 71.07 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.199 -0.667 . . . . 1.56 109.199 177.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.21 -34.09 76.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.464 0.649 . . . . 0.43 109.949 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.454 ' O ' ' HB ' ' A' ' 48' ' ' THR . 64.2 tp -63.13 -33.49 75.57 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.0 -1.0 . . . . 0.43 111.188 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.9 mtm -64.24 -33.81 76.66 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.413 -0.515 . . . . 1.49 110.775 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.08 -34.05 77.49 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-O 121.631 0.729 . . . . 1.88 109.556 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.74 HG21 HD23 ' A' ' 14' ' ' LEU . 37.2 m -66.21 -57.51 7.43 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.843 -1.169 . . . . 0.45 107.843 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.528 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.5 -36.17 66.38 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 113.963 -1.471 . . . . 0.27 109.595 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.16 -44.4 87.9 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 123.085 0.554 . . . . 0.33 112.279 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 38.0 mtp180 -66.19 -34.24 77.59 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.382 0.611 . . . . 2.84 109.975 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 49' ' ' ALA . 94.5 mt -65.71 -44.9 84.7 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.575 -0.739 . . . . 0.9 109.977 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.65 ' HA ' HG12 ' A' ' 58' ' ' VAL . 47.2 mt-10 -58.1 -44.17 87.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.48 109.927 174.751 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -61.3 -59.63 5.0 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.496 -1.229 . . . . 1.19 110.817 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -66.12 -41.94 89.83 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.77 1.026 . . . . 3.07 113.77 -177.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -95.26 -17.88 21.32 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.97 1.1 . . . . 1.01 113.97 -172.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.21 65.79 1.89 Allowed Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.012 -1.09 . . . . 0.93 110.858 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.65 HG12 ' HA ' ' A' ' 53' ' ' GLU . 10.6 p -140.63 176.18 5.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 107.969 -1.123 . . . . 1.16 107.969 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.476 ' H ' HG22 ' A' ' 58' ' ' VAL . 22.2 p -140.96 105.47 4.87 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.594 0.711 . . . . 1.87 110.01 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.407 HD12 ' HB1' ' A' ' 49' ' ' ALA . 73.7 mt -96.9 122.5 56.47 Favored Pre-proline 0 C--N 1.291 -1.955 0 CA-C-N 115.738 -0.664 . . . . 0.57 109.543 -174.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.89 128.47 26.87 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.715 2.277 . . . . 0.87 111.531 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -52.97 -37.78 61.5 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.777 1.231 . . . . 1.83 111.435 -178.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.54 -40.98 85.02 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 115.088 -0.96 . . . . 2.34 110.492 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.692 HG11 ' HG ' ' A' ' 77' ' ' LEU . 61.4 t -74.54 -45.05 46.54 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.221 -0.659 . . . . 0.66 109.221 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.23 -36.89 66.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.51 111.861 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.73 22.66 34.92 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.302 -0.952 . . . . 0.61 112.782 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -135.03 4.66 3.26 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.821 0.82 . . . . 3.98 110.162 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 m -82.01 124.08 38.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.009 -0.737 . . . . 0.44 109.009 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.37 -40.09 13.82 Favored 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 120.993 -0.283 . . . . 1.91 111.641 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 33.3 p -119.55 151.32 51.54 Favored Pre-proline 0 N--CA 1.417 -2.085 0 O-C-N 123.324 0.39 . . . . 0.47 110.672 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.568 ' HB2' HD23 ' A' ' 31' ' ' LEU . 68.6 Cg_exo -55.38 -32.24 80.8 Favored 'Trans proline' 0 C--O 1.206 -1.079 0 C-N-CA 123.657 2.905 . . . . 0.32 112.097 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.0 ttm105 -52.28 -48.26 65.41 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.769 0.668 . . . . 1.48 110.154 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -63.78 -48.9 75.09 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.95 0.9 . . . . 2.13 110.949 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.436 HD12 HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -66.48 -44.95 81.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.023 -0.99 . . . . 0.9 110.407 -176.023 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.7 tp -57.78 -47.22 83.18 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.135 0.574 . . . . 0.34 109.974 178.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.2 -47.71 80.58 Favored 'General case' 0 CA--C 1.506 -0.734 0 O-C-N 123.822 0.701 . . . . 0.57 111.689 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.692 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -59.66 -48.89 79.88 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 124.011 0.82 . . . . 1.96 109.872 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.9 mt -69.24 -39.22 78.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 116.164 -0.471 . . . . 0.55 110.541 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.501 ' HA ' HD11 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -60.65 -43.46 97.58 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.917 -0.129 . . . . 1.14 111.098 177.492 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.79 -42.59 98.47 Favored Glycine 0 N--CA 1.448 -0.531 0 O-C-N 123.481 0.488 . . . . 0.53 111.924 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.88 -42.9 72.85 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.072 0.463 . . . . 0.6 110.716 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.14 -14.61 62.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.881 0.697 . . . . 1.42 112.881 179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.779 0 CA-C-O 121.468 0.652 . . . . 0.85 109.686 173.896 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.458 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 30.1 tp . . . . . 0 N--CA 1.419 -1.995 0 N-CA-C 105.059 -2.2 . . . . 1.51 105.059 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 88.5 mt -122.86 123.03 40.08 Favored 'General case' 0 C--N 1.284 -2.243 0 N-CA-C 108.251 -1.018 . . . . 0.8 108.251 173.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.0 p -101.54 -170.47 1.83 Allowed 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 107.841 -1.17 . . . . 0.63 107.841 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.548 HG21 ' HA ' ' A' ' 29' ' ' ASP . 3.3 m -54.58 -54.57 39.62 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 123.294 0.638 . . . . 0.61 111.407 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -73.08 -28.47 62.31 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.703 -0.399 . . . . 1.65 111.805 -176.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.88 -38.56 86.53 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 108.636 -0.875 . . . . 1.41 108.636 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 75' ' ' LEU . 14.2 tp -66.48 -45.62 79.04 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.225 -0.898 . . . . 0.48 108.671 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.548 ' O ' HG23 ' A' ' 15' ' ' VAL . 2.5 tmt_? -50.62 -51.43 48.8 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.12 0.968 . . . . 2.46 109.709 175.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -57.72 -42.25 83.43 Favored 'General case' 0 C--N 1.313 -1.013 0 C-N-CA 124.824 1.249 . . . . 3.93 110.883 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.84 99.91 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 115.467 -0.788 . . . . 0.5 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.62 HD12 HG21 ' A' ' 48' ' ' THR . 11.1 mp -63.79 -41.64 97.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.98 -0.554 . . . . 1.44 111.133 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 11' ' ' ARG . 66.8 t -56.35 -55.98 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.526 -0.546 . . . . 0.8 109.526 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.407 ' HB3' ' NH1' ' A' ' 51' ' ' ARG . 34.5 mm-40 -54.91 -49.11 72.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.517 -0.765 . . . . 2.05 111.968 -178.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.5 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 4.0 m . . . . . 0 C--N 1.304 -1.374 0 N-CA-C 112.27 0.47 . . . . 1.39 112.27 -173.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.548 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.3 t70 . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.15 0.5 . . . . 2.07 110.251 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -115.82 13.29 16.07 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.683 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.784 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 48.6 mt -51.66 -21.68 2.84 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.687 1.736 . . . . 0.39 115.687 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -90.74 -21.63 21.47 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.181 0.515 . . . . 2.04 111.531 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mp -77.86 117.92 19.68 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 116.079 -0.51 . . . . 1.37 110.084 -175.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -71.92 144.84 48.82 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.648 -0.871 . . . . 3.94 108.648 -176.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.476 ' HA ' HG12 ' A' ' 38' ' ' ILE . 66.9 m-85 -57.26 -45.69 83.76 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.37 0.508 . . . . 0.35 112.37 -175.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.8 -31.19 70.58 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.712 0.767 . . . . 2.79 111.37 178.059 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -81.54 -17.82 47.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.242 -0.89 . . . . 0.88 109.939 -175.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.476 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.1 pt -101.8 14.47 5.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.381 0.61 . . . . 0.6 111.622 173.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.4 18.71 77.62 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.636 -0.711 . . . . 0.66 114.153 175.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -98.84 128.15 44.97 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 122.422 -0.457 . . . . 1.33 111.788 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -88.72 151.05 22.66 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.991 -1.114 . . . . 1.06 107.991 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.552 ' O ' ' HG3' ' A' ' 46' ' ' MET . 60.7 p -53.99 -28.38 37.51 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.456 0.539 . . . . 1.03 112.456 175.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.63 -58.6 6.95 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.365 -0.606 . . . . 1.56 109.365 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.095 0.474 . . . . 0.43 110.577 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.493 ' O ' ' HB ' ' A' ' 48' ' ' THR . 57.6 tp -62.54 -45.18 94.14 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.523 -0.762 . . . . 0.43 110.818 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.552 ' HG3' ' O ' ' A' ' 42' ' ' SER . 61.7 mtt -63.65 -40.71 97.55 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.6 0.238 . . . . 1.49 110.544 177.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.07 -29.02 70.19 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.767 0.794 . . . . 1.88 111.055 177.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.62 HG21 HD12 ' A' ' 14' ' ' LEU . 92.3 m -65.91 -54.8 21.71 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.152 -1.425 . . . . 0.45 107.152 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.523 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.6 -33.79 68.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.816 -1.538 . . . . 0.27 110.73 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.435 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -57.33 -46.99 82.72 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.408 0.683 . . . . 0.33 112.275 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.407 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 47.3 mtp180 -64.63 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.369 0.604 . . . . 2.84 109.782 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 49' ' ' ALA . 83.0 mt -66.67 -43.25 85.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.416 -0.811 . . . . 0.9 110.221 177.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.5 mt-10 -55.18 -53.74 52.12 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.175 -0.676 . . . . 0.48 109.175 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -62.64 -42.54 99.66 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.062 -0.972 . . . . 1.19 112.609 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.06 -42.71 93.95 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.488 0.551 . . . . 3.07 112.488 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -96.4 -0.23 49.59 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 113.932 1.086 . . . . 1.01 113.932 -173.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 67.64 48.27 57.27 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 111.241 -0.744 . . . . 0.93 111.241 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 59' ' ' SER . 12.7 p -139.01 176.01 6.92 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 N-CA-C 107.612 -1.255 . . . . 1.16 107.612 -177.279 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.412 ' H ' HG22 ' A' ' 58' ' ' VAL . 16.2 t -142.17 143.41 32.95 Favored 'General case' 0 N--CA 1.421 -1.905 0 N-CA-C 108.808 -0.812 . . . . 1.87 108.808 175.331 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.523 HD12 ' HB1' ' A' ' 49' ' ' ALA . 64.6 mt -121.82 123.39 27.43 Favored Pre-proline 0 C--N 1.296 -1.735 0 N-CA-C 107.417 -1.327 . . . . 0.57 107.417 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.07 138.91 81.31 Favored 'Trans proline' 0 C--O 1.254 1.278 0 C-N-CA 122.356 2.038 . . . . 0.87 111.158 177.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -53.54 -38.69 64.04 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.877 0.871 . . . . 1.83 111.296 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.53 -33.88 75.96 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.407 -0.361 . . . . 2.34 111.247 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 81.2 t -73.1 -50.17 33.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 N-CA-C 108.083 -1.081 . . . . 0.66 108.083 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.62 -26.35 61.44 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.198 -0.91 . . . . 0.51 112.396 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.89 0.98 51.81 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.615 -0.802 . . . . 0.61 113.635 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -98.63 -16.3 19.12 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 117.779 0.789 . . . . 3.98 110.631 -178.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.554 HG21 HD23 ' A' ' 74' ' ' LEU . 23.1 m -74.41 113.44 12.86 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-N 115.508 -0.769 . . . . 0.44 109.81 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -89.66 -39.03 13.47 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-N 115.553 -0.748 . . . . 1.91 111.801 -177.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 37.3 p -115.65 150.77 45.33 Favored Pre-proline 0 N--CA 1.416 -2.134 0 CA-C-N 115.675 -0.693 . . . . 0.47 109.969 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.784 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.2 Cg_exo -53.99 -40.45 81.03 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.623 2.882 . . . . 0.32 114.502 -178.161 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -36.48 64.13 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.698 0.681 . . . . 1.48 111.677 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -62.6 -53.54 53.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.274 -0.639 . . . . 2.13 109.274 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.554 HD23 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -65.38 -46.43 80.12 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.9 110.051 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.537 ' HB2' HD22 ' A' ' 10' ' ' LEU . 43.4 tp -58.17 -52.82 63.97 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.077 -0.51 . . . . 0.34 111.064 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.93 -39.37 93.4 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.012 0.375 . . . . 0.57 112.012 -176.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.21 -42.54 99.4 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.645 0.26 . . . . 1.96 111.236 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.26 -43.23 65.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 110.022 -0.362 . . . . 0.55 110.022 178.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -52.61 -47.23 67.1 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.713 0.405 . . . . 1.14 111.328 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.31 -44.19 96.73 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.628 -0.589 . . . . 0.53 111.628 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.95 74.78 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 122.814 0.446 . . . . 0.6 111.07 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 78.6 mt -67.74 -39.36 84.25 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 122.754 0.422 . . . . 1.42 110.352 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.755 -0.657 . . . . 0.85 110.357 176.853 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 82' ' ' LEU . 10.1 mp . . . . . 0 CA--C 1.486 -1.512 0 CA-C-O 121.538 0.685 . . . . 1.51 110.792 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 52' ' ' LEU . 38.9 mt -89.56 126.37 35.58 Favored 'General case' 0 C--N 1.273 -2.723 0 CA-C-N 114.385 -1.28 . . . . 0.8 109.873 -173.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.5 p -99.42 -170.13 1.86 Allowed 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 107.06 -1.459 . . . . 0.63 107.06 169.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 m -52.37 -54.21 34.81 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 118.399 0.545 . . . . 0.61 111.385 -178.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -64.43 -41.81 96.37 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 116.163 -0.471 . . . . 1.65 111.71 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -65.47 -43.5 90.07 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 121.185 0.517 . . . . 1.41 110.046 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.748 HD11 HD22 ' A' ' 74' ' ' LEU . 40.9 tp -65.58 -44.4 86.81 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.393 -0.821 . . . . 0.48 109.776 -178.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.476 ' O ' HG23 ' A' ' 15' ' ' VAL . 36.9 ttm105 -52.29 -44.4 65.0 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.709 0.631 . . . . 2.46 110.93 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 75.9 ttt180 -56.37 -40.05 73.94 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.531 0.519 . . . . 3.93 111.192 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.31 -37.48 85.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.711 0.291 . . . . 0.5 110.524 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.559 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.53 -34.28 77.56 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.192 -0.458 . . . . 1.44 110.28 175.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 11' ' ' ARG . 28.3 t -73.13 -29.79 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.415 0.626 . . . . 0.8 109.826 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 22.2 mm-40 -61.16 -53.11 61.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.457 -0.792 . . . . 2.05 110.168 177.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 112.061 0.393 . . . . 1.39 112.061 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.2 t70 . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 121.335 0.588 . . . . 2.07 110.003 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.401 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 10.2 p90 -113.23 13.08 19.13 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.785 -0.643 . . . . 0.44 111.207 -175.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.678 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 38.5 mt -52.11 -25.23 8.34 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.608 1.707 . . . . 0.39 115.608 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -100.24 -10.26 21.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 2.04 111.121 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -79.97 119.79 23.29 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.805 -0.443 . . . . 1.37 109.805 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.89 151.1 38.97 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.161 -0.472 . . . . 3.94 109.862 -175.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.633 ' HA ' HG12 ' A' ' 38' ' ' ILE . 68.9 m-85 -68.53 -37.07 79.68 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 116.305 -0.407 . . . . 0.35 110.585 -176.099 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -57.85 -29.26 64.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.165 0.507 . . . . 2.79 110.969 175.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -83.11 -31.46 27.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.711 -0.677 . . . . 0.88 111.22 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.633 HG12 ' HA ' ' A' ' 35' ' ' PHE . 34.9 pt -93.84 24.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.185 0.517 . . . . 0.6 111.922 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 36.24 91.03 Favored Glycine 0 N--CA 1.453 -0.183 0 CA-C-N 115.292 -0.867 . . . . 0.66 113.582 176.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.53 122.17 45.74 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.182 0.515 . . . . 1.33 112.129 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.72 148.72 24.62 Favored 'General case' 0 CA--C 1.485 -1.552 0 N-CA-C 107.821 -1.177 . . . . 1.06 107.821 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 46' ' ' MET . 31.1 p -54.75 -33.99 61.96 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 113.556 0.946 . . . . 1.03 113.556 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 tt -66.38 -45.24 80.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.066 -0.716 . . . . 1.56 109.066 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.41 87.49 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.099 -0.501 . . . . 0.43 110.043 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.404 HD21 HG23 ' A' ' 68' ' ' VAL . 55.6 tp -62.9 -39.36 94.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.273 -0.876 . . . . 0.43 111.185 178.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 42' ' ' SER . 65.5 mtm -64.08 -31.27 72.4 Favored 'General case' 0 C--O 1.199 -1.596 0 C-N-CA 120.66 -0.416 . . . . 1.49 110.969 177.199 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.55 -34.28 77.87 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.521 0.677 . . . . 1.88 110.191 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.559 HG21 HD13 ' A' ' 14' ' ' LEU . 35.8 m -64.12 -59.47 4.4 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 106.859 -1.534 . . . . 0.45 106.859 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.31 -38.08 70.78 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.05 -1.432 . . . . 0.27 110.16 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.0 80.84 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.242 0.617 . . . . 0.33 112.533 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -64.45 -36.39 84.0 Favored 'General case' 0 C--O 1.226 -0.171 0 N-CA-C 109.618 -0.512 . . . . 2.84 109.618 179.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.524 HD22 HD11 ' A' ' 5' ' ' LEU . 83.8 mt -64.97 -45.4 85.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.75 -0.659 . . . . 0.9 111.181 176.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 43.9 mt-10 -56.27 -50.53 71.11 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 122.845 0.458 . . . . 0.48 109.881 176.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -61.82 -43.21 99.31 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.68 -1.146 . . . . 1.19 110.095 -177.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.472 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 31.3 ttm180 -65.94 -52.39 50.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.334 -0.394 . . . . 3.07 111.902 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.472 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 85.3 m-85 -92.97 -17.55 23.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.376 1.251 . . . . 1.01 114.376 -170.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.8 53.11 4.71 Favored Glycine 0 C--N 1.312 -0.75 0 C-N-CA 119.99 -1.1 . . . . 0.93 110.762 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.09 140.66 43.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 N-CA-C 108.544 -0.909 . . . . 1.16 108.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 p -93.78 115.13 27.52 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 112.194 0.442 . . . . 1.87 112.194 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.2 mt -104.42 118.05 57.65 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.553 -0.906 . . . . 0.57 108.553 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -57.53 123.35 13.57 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.594 2.196 . . . . 0.87 111.313 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -50.38 -47.82 56.11 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.488 1.115 . . . . 1.83 113.692 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.31 -32.69 70.55 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 120.885 0.374 . . . . 2.34 110.641 -176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.26 -41.11 57.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 108.584 -0.895 . . . . 0.66 108.584 179.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.28 -33.96 68.17 Favored 'General case' 0 C--O 1.214 -0.78 0 C-N-CA 123.712 0.805 . . . . 0.51 111.589 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -90.41 -17.01 54.32 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.434 -0.889 . . . . 0.61 112.76 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -101.57 7.36 42.28 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.587 0.958 . . . . 3.98 113.587 -177.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.404 HG23 HD21 ' A' ' 45' ' ' LEU . 12.7 m -77.3 114.22 17.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 106.904 -1.517 . . . . 0.44 106.904 171.586 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -90.36 -34.69 15.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 121.619 0.723 . . . . 1.91 110.527 -173.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.406 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 67.9 p -117.42 142.52 30.45 Favored Pre-proline 0 N--CA 1.411 -2.423 0 CA-C-N 115.343 -0.844 . . . . 0.47 109.961 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.678 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 76.9 Cg_exo -55.5 -28.9 66.72 Favored 'Trans proline' 0 CA--C 1.499 -1.24 0 C-N-CA 123.866 3.044 . . . . 0.32 111.946 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -50.3 -51.71 42.85 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 124.425 1.078 . . . . 1.48 109.668 174.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -65.67 -42.48 91.26 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 115.101 -0.954 . . . . 2.13 111.249 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.748 HD22 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -66.49 -44.07 83.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.964 -0.754 . . . . 0.9 108.964 -177.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -56.98 -51.86 67.54 Favored 'General case' 0 C--O 1.245 0.854 0 C-N-CA 123.525 0.73 . . . . 0.34 109.226 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.35 -44.07 92.72 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.813 -1.085 . . . . 0.57 111.407 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.7 tp -57.85 -50.06 74.59 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.751 0.82 . . . . 1.96 111.341 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.7 mt -70.55 -40.29 77.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.393 -0.523 . . . . 0.55 110.724 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.432 ' OD1' HD23 ' A' ' 4' ' ' LEU . 13.8 m-80 -60.99 -39.63 90.4 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.48 0.181 . . . . 1.14 110.745 177.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.85 -39.78 64.67 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.314 -0.469 . . . . 0.53 112.445 178.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.65 -45.03 65.91 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.838 0.352 . . . . 0.6 110.936 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 4' ' ' LEU . 21.5 mt -69.36 -15.5 63.33 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.402 0.681 . . . . 1.42 112.486 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.525 0 CA-C-O 121.526 0.679 . . . . 0.85 109.182 173.031 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 28.9 tp . . . . . 0 N--CA 1.405 -2.709 0 N-CA-C 106.227 -1.768 . . . . 1.51 106.227 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.441 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 85.9 mt -120.14 123.67 43.9 Favored 'General case' 0 N--CA 1.406 -2.665 0 N-CA-C 108.273 -1.01 . . . . 0.8 108.273 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.7 p -98.37 -179.87 4.49 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 106.585 -1.635 . . . . 0.63 106.585 172.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.783 HG21 ' HA ' ' A' ' 29' ' ' ASP . 20.6 m -59.47 -31.93 69.78 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 118.638 0.654 . . . . 0.61 110.505 175.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.24 -46.72 63.89 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.44 -0.578 . . . . 1.65 109.44 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -64.51 -39.54 93.96 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.589 -0.732 . . . . 1.41 109.527 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.554 HD11 HD12 ' A' ' 74' ' ' LEU . 15.0 tp -65.49 -51.38 60.48 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 114.893 -1.048 . . . . 0.48 109.195 -177.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -52.32 -40.65 62.15 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 2.46 111.766 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.535 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 60.6 ttt180 -54.3 -54.52 39.09 Favored 'General case' 0 C--O 1.24 0.577 0 O-C-N 123.549 0.531 . . . . 3.93 110.586 176.321 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.46 -39.13 89.76 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.536 -0.756 . . . . 0.5 111.547 -175.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.8 -50.99 68.84 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.162 0.288 . . . . 1.44 111.174 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.8 t -63.52 -34.72 69.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 CA-C-O 120.999 0.428 . . . . 0.8 111.46 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 95.6 mt-10 -63.22 -49.31 74.68 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.245 0.545 . . . . 2.05 111.218 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 p . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 115.473 -0.785 . . . . 1.39 112.889 -174.744 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.783 ' HA ' HG21 ' A' ' 7' ' ' THR . 10.2 m-20 . . . . . 0 CA--C 1.496 -1.115 0 N-CA-C 109.064 -0.717 . . . . 2.07 109.064 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.411 ' HB2' HD12 ' A' ' 33' ' ' LEU . 23.6 p90 -123.32 19.08 9.8 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.943 -0.762 . . . . 0.44 108.943 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.687 HD13 ' HB3' ' A' ' 72' ' ' ARG . 29.3 mt -53.63 -23.19 10.39 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.58 1.326 . . . . 0.39 114.58 -175.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -92.0 -22.53 19.93 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.894 0.378 . . . . 2.04 110.475 -176.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.411 HD12 ' HB2' ' A' ' 30' ' ' PHE . 66.3 mt -77.59 114.09 16.08 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.824 -1.176 . . . . 1.37 107.824 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -75.72 146.74 39.87 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 120.128 -0.629 . . . . 3.94 109.631 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.568 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.5 m-85 -55.22 -40.88 71.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.993 -0.549 . . . . 0.35 111.424 -175.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.06 -34.78 63.87 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.814 -0.63 . . . . 2.79 111.724 178.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.2 -34.23 32.42 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.143 -0.481 . . . . 0.88 110.259 -174.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 pt -90.8 17.7 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 113.118 0.784 . . . . 0.6 113.118 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.81 14.47 67.47 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 114.564 0.586 . . . . 0.66 114.564 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.568 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 32.6 m-85 -101.33 115.17 29.88 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 120.796 0.331 . . . . 1.33 111.418 -179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -87.22 154.54 20.63 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.427 -1.694 . . . . 1.06 106.427 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.554 ' O ' ' HG3' ' A' ' 46' ' ' MET . 44.1 p -51.44 -27.88 11.46 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 113.509 0.929 . . . . 1.03 113.509 177.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.35 -57.76 8.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.162 -0.681 . . . . 1.56 109.162 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.68 78.25 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.23 0.538 . . . . 0.43 110.391 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 57.8 tp -62.69 -33.6 75.4 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.121 -0.945 . . . . 0.43 110.95 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.554 ' HG3' ' O ' ' A' ' 42' ' ' SER . 69.3 mtm -65.81 -29.76 70.29 Favored 'General case' 0 C--O 1.199 -1.559 0 C-N-CA 120.164 -0.615 . . . . 1.49 112.084 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 36.2 tt0 -65.79 -29.12 69.56 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.803 0.811 . . . . 1.88 109.505 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 24.6 m -64.62 -58.01 7.5 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 106.193 -1.78 . . . . 0.45 106.193 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.33 -38.44 74.11 Favored 'General case' 0 C--O 1.2 -1.523 0 CA-C-N 113.875 -1.512 . . . . 0.27 110.759 176.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.66 -45.31 81.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.531 0.732 . . . . 0.33 112.348 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.522 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 50.6 mtt180 -64.83 -38.63 91.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.744 -0.662 . . . . 2.84 109.572 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 48' ' ' THR . 86.7 mt -65.71 -41.39 92.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.055 -0.975 . . . . 0.9 110.271 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 37.7 mt-10 -57.0 -54.85 42.11 Favored 'General case' 0 CA--C 1.502 -0.885 0 O-C-N 123.624 0.577 . . . . 0.48 109.813 175.594 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.3 t -62.33 -38.5 89.7 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.501 -0.772 . . . . 1.19 111.928 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -68.1 -51.02 51.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.693 0.627 . . . . 3.07 112.693 177.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.474 ' HB2' HG12 ' A' ' 58' ' ' VAL . 65.0 m-85 -93.77 -12.38 29.25 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.749 1.018 . . . . 1.01 113.749 -171.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.63 17.94 79.45 Favored Glycine 0 C--N 1.308 -1.006 0 C-N-CA 120.698 -0.763 . . . . 0.93 111.285 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.474 HG12 ' HB2' ' A' ' 56' ' ' TYR . 7.5 p -98.38 135.06 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 N-CA-C 107.948 -1.13 . . . . 1.16 107.948 -178.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 m -92.87 118.45 31.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.997 -0.742 . . . . 1.87 108.997 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.1 mt -103.29 117.55 59.96 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.548 -0.908 . . . . 0.57 108.548 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.34 128.19 29.1 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.839 2.359 . . . . 0.87 110.977 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -51.28 -38.75 54.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.363 1.065 . . . . 1.83 111.943 -177.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.68 -45.31 79.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.901 -0.591 . . . . 2.34 110.652 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.99 -36.06 56.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 O-C-N 123.428 0.455 . . . . 0.66 109.879 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.48 -32.17 64.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.475 -0.784 . . . . 0.51 111.365 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 42' ' ' SER . . . -116.98 23.13 10.15 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.5 -0.857 . . . . 0.61 112.297 178.097 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -101.15 -22.16 14.76 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.45 0.643 . . . . 3.98 110.334 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.509 HG21 ' HB2' ' A' ' 74' ' ' LEU . 17.8 m -76.19 130.8 35.89 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 CA-C-N 114.984 -1.007 . . . . 0.44 111.594 -175.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.43 -50.09 6.78 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.706 -0.679 . . . . 1.91 111.343 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 32.2 p -109.13 149.23 39.4 Favored Pre-proline 0 N--CA 1.405 -2.701 0 CA-C-N 115.846 -0.615 . . . . 0.47 110.479 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.494 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 89.3 Cg_exo -51.82 -38.81 68.32 Favored 'Trans proline' 0 C--O 1.211 -0.831 0 C-N-CA 123.269 2.646 . . . . 0.32 112.228 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.687 ' HB3' HD13 ' A' ' 31' ' ' LEU . 13.6 ptt180 -55.63 -35.17 65.6 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.676 0.991 . . . . 1.48 113.676 176.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -63.78 -50.62 68.29 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.791 0.805 . . . . 2.13 109.137 176.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.554 HD12 HD11 ' A' ' 10' ' ' LEU . 3.4 tm? -66.57 -47.22 73.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.319 -1.31 . . . . 0.9 109.906 -176.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.415 HD13 HD22 ' A' ' 10' ' ' LEU . 51.4 tp -56.78 -48.77 77.12 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.646 0.778 . . . . 0.34 110.735 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.68 -44.05 82.82 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.346 -0.388 . . . . 0.57 111.52 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.11 -47.94 83.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.004 -0.544 . . . . 1.96 109.565 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.15 -35.21 52.44 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 C-N-CA 120.158 -0.617 . . . . 0.55 111.439 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.1 -44.02 82.8 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 117.969 0.35 . . . . 1.14 110.8 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.18 -43.33 98.77 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.541 -0.624 . . . . 0.53 111.541 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.58 -25.77 65.06 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.974 0.416 . . . . 0.6 111.271 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 66.6 mt -79.58 -40.66 28.9 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 116.207 -0.451 . . . . 1.42 110.513 177.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.62 0 CA-C-O 121.439 0.638 . . . . 0.85 110.174 177.29 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' A' ' 82' ' ' LEU . 11.5 tp . . . . . 0 N--CA 1.407 -2.6 0 CA-C-O 122.031 0.919 . . . . 1.51 112.498 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.428 HD21 ' CZ ' ' A' ' 56' ' ' TYR . 96.4 mt -101.66 131.34 47.94 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 114.419 -1.264 . . . . 0.8 108.941 176.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p -102.22 -176.44 3.12 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.963 -1.495 . . . . 0.63 106.963 170.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.0 m -58.14 -39.7 79.44 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 118.284 0.493 . . . . 0.61 111.371 177.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.84 -42.53 94.84 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.104 0.478 . . . . 1.65 110.05 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -67.89 -41.19 83.14 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.685 -0.689 . . . . 1.41 109.601 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.428 HD11 ' CD1' ' A' ' 74' ' ' LEU . 28.0 tp -64.82 -43.82 91.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.762 -1.108 . . . . 0.48 110.539 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 11' ' ' ARG . 40.3 ttp180 -49.93 -41.74 46.92 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.471 0.708 . . . . 2.46 111.92 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.418 ' HG2' ' OE2' ' A' ' 16' ' ' GLU . 40.6 ttm180 -55.47 -43.76 75.8 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.915 0.76 . . . . 3.93 111.116 -177.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.465 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -63.68 -42.08 98.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.239 -0.437 . . . . 0.5 110.839 -178.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.648 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -64.83 -37.06 86.34 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.358 -0.383 . . . . 1.44 110.519 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.64 -53.31 32.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 N-CA-C 109.937 -0.394 . . . . 0.8 109.937 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.418 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.9 mt-10 -58.97 -40.6 85.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.902 -0.59 . . . . 2.05 112.503 -177.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.9 p . . . . . 0 C--N 1.318 -0.792 0 C-N-CA 119.998 -0.681 . . . . 1.39 112.465 -179.423 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.766 ' HA ' HG21 ' A' ' 7' ' ' THR . 6.6 p-10 . . . . . 0 N--CA 1.433 -1.285 0 N-CA-C 108.591 -0.892 . . . . 2.07 108.591 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.32 19.49 15.51 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.49 0.662 . . . . 0.44 109.518 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.64 ' O ' ' HB ' ' A' ' 70' ' ' THR . 59.5 mt -51.98 -32.08 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 114.716 1.376 . . . . 0.39 114.716 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -94.73 -1.88 52.15 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.101 0.477 . . . . 2.04 112.007 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp -81.34 129.52 34.66 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.722 -0.844 . . . . 1.37 108.722 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 142.61 43.77 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 108.033 -1.099 . . . . 3.94 108.033 -177.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' HA ' HG12 ' A' ' 38' ' ' ILE . 73.2 m-85 -60.13 -41.8 93.45 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 120.546 -0.462 . . . . 0.35 109.8 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.25 -27.02 61.7 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.039 -0.528 . . . . 2.79 112.101 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.19 -34.47 37.39 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.651 -0.87 . . . . 0.88 108.651 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.525 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.8 pt -91.64 16.95 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.049 0.452 . . . . 0.6 110.803 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.84 55.77 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.55 -0.75 . . . . 0.66 113.701 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -118.09 108.93 15.82 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 113.156 0.798 . . . . 1.33 113.156 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.35 147.45 26.52 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 106.924 -1.51 . . . . 1.06 106.924 174.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.521 ' O ' ' HG3' ' A' ' 46' ' ' MET . 18.0 p -50.87 -31.04 16.14 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 114.237 1.199 . . . . 1.03 114.237 -178.333 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.77 -53.94 43.06 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.226 -1.028 . . . . 1.56 108.226 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.51 -35.24 79.83 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.29 0.567 . . . . 0.43 110.32 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 59.8 tp -61.57 -37.71 84.84 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.352 -0.84 . . . . 0.43 111.615 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.521 ' HG3' ' O ' ' A' ' 42' ' ' SER . 59.9 mtm -63.78 -33.4 75.57 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 120.735 -0.386 . . . . 1.49 110.657 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -66.78 -32.18 73.3 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 121.946 0.879 . . . . 1.88 109.805 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.648 HG21 HD13 ' A' ' 14' ' ' LEU . 55.6 m -66.52 -55.86 13.57 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.411 -1.329 . . . . 0.45 107.411 178.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.511 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -55.92 -38.21 69.97 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.72 -1.582 . . . . 0.27 109.855 177.373 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.85 80.26 Favored 'General case' 0 C--O 1.251 1.17 0 C-N-CA 123.099 0.56 . . . . 0.33 112.45 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 -66.31 -38.72 88.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.967 -0.561 . . . . 2.84 109.724 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 13' ' ' ALA . 85.4 mt -63.98 -45.68 87.98 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.422 -0.808 . . . . 0.9 110.498 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.8 mt-10 -56.53 -49.6 74.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.83 -0.623 . . . . 0.48 110.084 176.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.2 t -62.37 -54.73 36.17 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.983 -1.008 . . . . 1.19 110.894 -177.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.91 -38.13 89.94 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.375 0.879 . . . . 3.07 113.375 -174.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.428 ' CZ ' HD21 ' A' ' 5' ' ' LEU . 99.4 m-85 -98.7 -9.52 24.5 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 114.504 1.298 . . . . 1.01 114.504 -173.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.42 50.58 8.11 Favored Glycine 0 C--N 1.316 -0.557 0 C-N-CA 120.278 -0.963 . . . . 0.93 111.792 178.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.3 p -142.61 175.48 4.42 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 N-CA-C 106.96 -1.496 . . . . 1.16 106.96 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.6 t -142.22 139.34 31.97 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 119.19 0.905 . . . . 1.87 109.802 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.511 HD12 ' HB1' ' A' ' 49' ' ' ALA . 70.5 mt -114.1 129.46 24.79 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 108.043 -1.095 . . . . 0.57 108.043 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.73 113.98 2.21 Favored 'Trans proline' 0 C--O 1.245 0.844 0 C-N-CA 122.005 1.803 . . . . 0.87 109.742 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -55.49 -29.72 59.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.612 0.765 . . . . 1.83 113.004 -176.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -68.63 -41.03 80.02 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.823 -0.436 . . . . 2.34 109.823 178.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.2 t -75.17 -34.79 32.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.163 -0.68 . . . . 0.66 109.163 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.08 65.54 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.694 -0.685 . . . . 0.51 110.99 176.147 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -91.8 -3.74 68.1 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.591 -0.814 . . . . 0.61 112.76 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -101.37 -14.45 17.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.333 0.587 . . . . 3.98 110.829 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.4 m -76.17 124.25 33.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 CA-C-O 121.047 0.451 . . . . 0.44 109.904 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -92.29 -33.18 14.73 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 115.915 -0.584 . . . . 1.91 111.712 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.64 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 40.2 p -125.63 152.25 71.75 Favored Pre-proline 0 N--CA 1.418 -2.037 0 CA-C-N 115.645 -0.707 . . . . 0.47 110.085 -177.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.588 ' HB2' HD23 ' A' ' 31' ' ' LEU . 54.2 Cg_exo -56.37 -26.3 61.73 Favored 'Trans proline' 0 C--O 1.2 -1.409 0 C-N-CA 123.57 2.846 . . . . 0.32 111.109 176.59 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -51.22 -57.21 9.4 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.84 0.856 . . . . 1.48 109.961 174.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -64.32 -41.11 96.99 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.463 -0.789 . . . . 2.13 110.885 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.428 ' CD1' HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -67.54 -46.17 73.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.47 -0.786 . . . . 0.9 110.691 -177.396 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.6 tp -57.6 -52.16 66.56 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.007 -0.738 . . . . 0.34 109.007 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -52.39 -44.6 65.43 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.811 1.244 . . . . 0.57 111.414 177.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 67.9 tp -62.38 -51.3 68.11 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.732 0.813 . . . . 1.96 111.197 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 74' ' ' LEU . 58.8 mt -66.33 -39.75 84.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.165 -0.47 . . . . 0.55 110.119 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.95 -43.8 86.58 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.411 -0.359 . . . . 1.14 110.121 176.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.23 -42.7 97.8 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.575 -0.739 . . . . 0.53 112.003 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.84 79.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.757 0.313 . . . . 0.6 110.746 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 4' ' ' LEU . 71.0 mt -65.58 -36.65 84.39 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.647 0.379 . . . . 1.42 110.978 176.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.63 0 CA-C-N 116.069 -0.514 . . . . 0.85 110.6 176.168 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mtp . . . . . 0 CA--C 1.506 -0.747 0 N-CA-C 107.458 -1.312 . . . . 6.63 107.458 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.16 -39.27 66.39 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.487 -0.931 . . . . 4.09 108.487 174.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.527 ' O ' ' HB3' ' A' ' 82' ' ' LEU . 1.9 p -73.08 108.29 5.9 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-N 113.79 -1.55 . . . . 2.77 108.806 173.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.6 tp -158.33 152.19 23.72 Favored 'General case' 0 N--CA 1.389 -3.509 0 CA-C-N 114.756 -1.111 . . . . 1.51 108.636 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.5 HD21 ' CE2' ' A' ' 56' ' ' TYR . 88.7 mt -116.19 130.91 57.02 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 108.193 -1.04 . . . . 0.8 108.193 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.3 p -102.02 -174.82 2.67 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 108.017 -1.105 . . . . 0.63 108.017 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.912 HG21 ' HA ' ' A' ' 29' ' ' ASP . 12.0 m -57.01 -45.71 82.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.02 0.438 . . . . 0.61 110.278 178.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 18.0 t70 -57.22 -45.17 84.12 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.861 0.864 . . . . 1.65 111.298 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 5' ' ' LEU . 15.4 m-20 -67.1 -39.66 86.75 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.367 0.603 . . . . 1.41 110.102 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.4 HD11 ' CD1' ' A' ' 74' ' ' LEU . 9.8 tp -65.94 -42.46 90.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.099 -0.955 . . . . 0.48 109.04 -177.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.533 ' HG3' ' HB3' ' A' ' 26' ' ' LEU . 39.0 ttm180 -53.02 -48.74 67.33 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.135 -0.939 . . . . 2.46 109.518 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.557 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 48.3 mtt180 -54.03 -44.53 71.06 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.016 -0.993 . . . . 3.93 111.648 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.93 91.7 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.53 0.519 . . . . 0.5 110.719 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.42 HD12 HG21 ' A' ' 48' ' ' THR . 9.4 mp -67.3 -31.64 72.07 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.998 0.37 . . . . 1.44 111.998 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 11' ' ' ARG . 95.6 t -64.75 -48.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 N-CA-C 108.581 -0.896 . . . . 0.8 108.581 175.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 47.0 mt-10 -58.14 -48.03 81.49 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.623 -0.717 . . . . 2.05 110.991 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.9 p -73.78 -17.03 61.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.305 0.854 . . . . 1.39 113.305 -177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -86.82 -23.97 25.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.079 0.466 . . . . 1.58 110.281 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.43 -132.85 11.09 Favored Glycine 0 N--CA 1.434 -1.448 0 N-CA-C 111.48 -0.648 . . . . 2.32 111.48 177.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -85.29 92.49 8.45 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 121.359 0.6 . . . . 5.17 109.894 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -132.89 174.31 10.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 114.955 -1.021 . . . . 4.86 109.789 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -98.72 -15.78 19.23 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 107.763 -1.199 . . . . 4.5 107.763 176.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.69 6.17 56.4 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-N 114.937 -1.028 . . . . 2.77 111.197 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 74.3 p 40.34 -115.85 0.23 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.242 1.417 . . . . 2.87 114.361 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -104.22 20.12 18.93 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 115.356 -0.838 . . . . 3.23 112.026 -177.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.533 ' HB3' ' HG3' ' A' ' 11' ' ' ARG . 9.1 mp -81.65 2.9 27.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.01 0.434 . . . . 1.16 110.93 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.2 m -60.88 135.83 57.9 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 124.277 1.031 . . . . 1.46 110.175 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.13 -138.16 32.45 Favored Glycine 0 N--CA 1.434 -1.495 0 N-CA-C 110.917 -0.873 . . . . 1.02 110.917 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.912 ' HA ' HG21 ' A' ' 7' ' ' THR . 5.2 m-20 -92.05 113.62 25.94 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 109.521 -0.548 . . . . 2.07 109.521 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' HD13 ' A' ' 33' ' ' LEU . 18.7 p90 -109.0 14.13 24.24 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.093 -0.706 . . . . 0.44 109.093 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.776 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 67.2 mt -53.54 -26.85 22.91 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 113.608 0.966 . . . . 0.39 113.608 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -95.11 -11.01 29.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.3 -0.409 . . . . 2.04 111.274 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.5 mp -82.05 116.25 21.56 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.659 -0.867 . . . . 1.37 108.659 175.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -75.7 149.89 37.99 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 115.287 -0.87 . . . . 3.94 110.426 -173.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.485 ' HA ' HG12 ' A' ' 38' ' ' ILE . 56.7 m-85 -61.96 -39.84 93.52 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.423 -0.353 . . . . 0.35 111.097 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -58.01 -31.99 67.49 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.401 0.619 . . . . 2.79 111.137 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -82.37 -26.01 33.29 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.349 -0.841 . . . . 0.88 111.246 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.485 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.3 pt -98.07 14.42 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.097 0.475 . . . . 0.6 111.245 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.39 40.96 99.73 Favored Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.767 -0.651 . . . . 0.66 113.116 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.447 ' HB2' HG13 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -115.97 113.96 23.97 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.482 -0.562 . . . . 1.33 109.482 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -85.83 156.94 20.35 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.338 -0.616 . . . . 1.06 109.338 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 46' ' ' MET . 24.4 p -53.39 -33.75 54.99 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.108 0.781 . . . . 1.03 113.108 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.3 -49.13 70.66 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.927 -0.768 . . . . 1.56 108.927 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.51 96.62 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 109.605 -0.517 . . . . 0.43 109.605 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 68' ' ' VAL . 63.8 tp -60.62 -41.65 95.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.995 -1.002 . . . . 0.43 111.223 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.8 mtp -61.68 -40.58 95.47 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-N 116.609 -0.269 . . . . 1.49 110.344 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 34.5 tt0 -65.42 -34.86 79.29 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.471 0.653 . . . . 1.88 110.511 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.42 HG21 HD12 ' A' ' 14' ' ' LEU . 60.1 m -64.03 -56.74 12.88 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 107.252 -1.388 . . . . 0.45 107.252 178.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.55 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.0 -36.27 70.21 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 113.923 -1.489 . . . . 0.27 109.995 176.546 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.512 ' HA ' ' OE1' ' A' ' 53' ' ' GLU . . . -58.68 -40.99 85.16 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.466 0.706 . . . . 0.33 112.414 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 62.6 mtp85 -63.35 -42.32 98.9 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.376 -0.972 . . . . 2.84 108.376 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.32 -41.75 89.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.389 -1.278 . . . . 0.9 111.185 178.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.512 ' OE1' ' HA ' ' A' ' 50' ' ' ALA . 50.2 mt-10 -55.81 -53.2 59.57 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 123.262 0.625 . . . . 0.48 109.836 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.8 m -62.49 -46.62 87.61 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 114.938 -1.028 . . . . 1.19 111.357 -178.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -65.46 -45.78 82.43 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.7 -0.682 . . . . 3.07 112.373 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.5 ' CE2' HD21 ' A' ' 5' ' ' LEU . 94.0 m-85 -97.19 6.37 48.55 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.179 0.807 . . . . 1.01 113.179 -175.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.29 52.72 49.82 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 115.984 -0.553 . . . . 0.93 112.188 177.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.526 HG11 HD12 ' A' ' 82' ' ' LEU . 28.6 m -132.86 176.52 8.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.665 -0.494 . . . . 1.16 109.665 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 t -141.9 129.62 21.62 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.95 -1.13 . . . . 1.87 107.95 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.55 HD12 ' HB1' ' A' ' 49' ' ' ALA . 92.9 mt -106.93 124.19 36.16 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.926 -0.579 . . . . 0.57 109.513 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 126.5 21.73 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.048 2.499 . . . . 0.87 111.719 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -52.99 -30.75 36.99 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.809 1.244 . . . . 1.83 113.43 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 11.4 t70 -69.82 -47.65 61.99 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.276 -0.639 . . . . 2.34 109.276 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -72.4 -33.25 45.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.495 -0.775 . . . . 0.66 110.618 -174.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.69 -27.42 62.89 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.862 -0.608 . . . . 0.51 111.443 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.85 19.43 8.91 Favored Glycine 0 N--CA 1.434 -1.455 0 N-CA-C 111.06 -0.816 . . . . 0.61 111.06 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 14.5 tpp180 -100.9 -19.27 15.98 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.254 -0.647 . . . . 3.98 109.254 -178.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.461 HG23 HD21 ' A' ' 45' ' ' LEU . 30.2 m -79.05 123.7 36.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-N 115.04 -0.982 . . . . 0.44 111.615 -177.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -91.71 -31.78 15.68 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.279 -0.873 . . . . 1.91 110.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 21.5 p -125.22 145.25 50.02 Favored Pre-proline 0 N--CA 1.418 -2.034 0 CA-C-N 115.337 -0.847 . . . . 0.47 110.395 -176.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.776 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 77.1 Cg_exo -54.03 -32.1 67.24 Favored 'Trans proline' 0 C--O 1.215 -0.648 0 C-N-CA 123.732 2.954 . . . . 0.32 113.192 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -52.9 -43.38 66.14 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.222 0.326 . . . . 1.48 111.774 176.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -64.55 -48.05 76.51 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.595 0.758 . . . . 2.13 109.978 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.458 ' HB2' HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -66.4 -42.09 88.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.925 -1.034 . . . . 0.9 110.114 -176.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.07 -52.31 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.552 -0.536 . . . . 0.34 109.552 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.7 -43.32 94.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.5 -0.773 . . . . 0.57 111.763 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.61 -46.9 87.58 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 109.781 -0.451 . . . . 1.96 109.781 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.79 -35.42 55.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 C-N-CA 120.944 -0.302 . . . . 0.55 110.583 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -40.79 89.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 120.689 0.28 . . . . 1.14 110.47 175.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.01 -32.43 69.6 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.776 -0.647 . . . . 0.53 112.449 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.12 60.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.819 0.819 . . . . 0.6 109.641 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.527 ' HB3' ' O ' ' A' ' 3' ' ' THR . 8.5 mp -72.62 -6.7 46.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.075 -0.966 . . . . 1.42 111.724 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.02 -28.28 66.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.549 0.69 . . . . 0.85 109.904 170.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -108.56 -34.22 6.8 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.562 -0.745 . . . . 2.44 111.679 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -107.3 140.44 40.21 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.307 0.575 . . . . 2.12 112.072 -176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.472 ' HA ' HG21 ' A' ' 3' ' ' THR . . . . . . . . 0 N--CA 1.429 -1.52 0 N-CA-C 108.291 -1.003 . . . . 3.84 108.291 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.447 ' HG2' ' HA ' ' A' ' 86' ' ' ALA . 66.4 mtt . . . . . 0 CA--C 1.506 -0.713 0 N-CA-C 110.3 -0.259 . . . . 6.63 110.3 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.83 144.66 46.21 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.505 -0.554 . . . . 4.09 109.505 178.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 t -89.04 123.24 33.16 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 122.116 0.96 . . . . 2.77 109.772 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.15 151.99 29.78 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-N 113.585 -1.643 . . . . 1.51 110.714 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.532 HD11 HD12 ' A' ' 52' ' ' LEU . 73.8 mt -98.9 133.27 43.42 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.604 -0.726 . . . . 0.8 110.024 -178.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 p -99.92 -176.6 3.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.457 -1.312 . . . . 0.63 107.457 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.675 HG21 ' HA ' ' A' ' 29' ' ' ASP . 16.7 m -57.64 -38.86 75.76 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.11 -0.7 . . . . 0.61 109.11 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -60.03 -47.43 85.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.781 -1.1 . . . . 1.65 111.272 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.22 -39.76 89.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.835 -0.621 . . . . 1.41 110.098 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 17.3 tp -65.08 -45.05 86.85 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.943 -1.026 . . . . 0.48 109.265 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.488 ' NE ' ' HA ' ' A' ' 27' ' ' SER . 36.8 ttm180 -50.75 -54.56 22.35 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 124.0 0.92 . . . . 2.46 109.914 177.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 23.3 ttp180 -56.05 -46.33 78.94 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.67 -1.15 . . . . 3.93 111.689 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.535 ' HB1' HD21 ' A' ' 52' ' ' LEU . . . -62.16 -40.65 96.7 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.367 0.417 . . . . 0.5 111.281 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.12 -38.65 91.82 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.634 0.254 . . . . 1.44 111.34 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 11' ' ' ARG . 89.3 t -66.71 -47.59 82.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.857 -0.423 . . . . 0.8 109.857 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 45.9 mt-10 -59.37 -39.69 84.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.289 -0.414 . . . . 2.05 111.021 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.573 ' CB ' ' HA ' ' A' ' 48' ' ' THR . 20.6 m -75.27 -15.79 60.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.302 0.573 . . . . 1.39 112.114 -178.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.3 -6.72 49.76 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.551 -0.907 . . . . 1.58 108.551 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.24 -97.19 1.66 Allowed Glycine 0 N--CA 1.429 -1.775 0 N-CA-C 108.942 -1.663 . . . . 2.32 108.942 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -162.28 93.23 0.85 Allowed 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 106.837 -1.542 . . . . 5.17 106.837 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -115.42 -85.75 0.61 Allowed 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 115.345 -0.843 . . . . 4.86 109.17 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -114.99 -53.78 2.61 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 108.834 -0.802 . . . . 4.5 108.834 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.79 -22.37 21.93 Favored Glycine 0 C--O 1.242 0.603 0 CA-C-N 116.012 -0.54 . . . . 2.77 113.551 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.5 p 53.24 -169.01 0.05 OUTLIER 'General case' 0 C--O 1.249 1.064 0 C-N-CA 125.734 1.614 . . . . 2.87 112.629 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -97.38 83.13 3.23 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 105.328 -2.101 . . . . 3.23 105.328 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.8 tp -101.18 -1.84 32.85 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.745 -1.116 . . . . 1.16 109.342 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.488 ' HA ' ' NE ' ' A' ' 11' ' ' ARG . 19.8 m -69.09 143.69 54.14 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.874 -1.057 . . . . 1.46 109.714 178.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.54 -161.56 19.67 Favored Glycine 0 N--CA 1.422 -2.247 0 N-CA-C 109.168 -1.573 . . . . 1.02 109.168 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.675 ' HA ' HG21 ' A' ' 7' ' ' THR . 19.9 t70 -97.5 106.14 18.4 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.609 -0.885 . . . . 2.07 108.609 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.442 ' HB2' HD12 ' A' ' 33' ' ' LEU . 25.1 p90 -101.32 14.92 30.47 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.431 -0.35 . . . . 0.44 111.624 -175.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.72 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 41.0 mt -52.75 -25.62 11.72 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.919 1.451 . . . . 0.39 114.919 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -92.19 -16.94 25.56 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.945 0.402 . . . . 2.04 111.315 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 30' ' ' PHE . 81.2 mt -77.53 114.78 16.72 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 121.308 0.575 . . . . 1.37 109.735 -176.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HG2' HG22 ' A' ' 70' ' ' THR . 46.1 mtp180 -72.64 141.01 48.31 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.19 -0.914 . . . . 3.94 109.903 -172.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 38.9 m-85 -60.69 -39.35 88.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.501 -0.318 . . . . 0.35 110.258 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -56.7 -31.78 64.83 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.517 0.727 . . . . 2.79 111.142 177.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -82.65 -34.34 27.52 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.087 -0.506 . . . . 0.88 110.91 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.468 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.1 pt -90.79 9.71 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 112.511 0.56 . . . . 0.6 112.511 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.51 29.88 31.63 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.639 -0.709 . . . . 0.66 114.401 174.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 8.6 m-85 -111.59 121.46 45.21 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 117.25 0.525 . . . . 1.33 111.271 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -84.65 152.62 23.66 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 107.093 -1.447 . . . . 1.06 107.093 173.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.443 ' O ' ' HG3' ' A' ' 46' ' ' MET . 13.5 p -54.27 -30.44 50.57 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.914 0.709 . . . . 1.03 112.914 176.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.33 -52.37 54.32 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.08 -0.711 . . . . 1.56 109.08 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.26 -33.04 74.63 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.372 0.606 . . . . 0.43 110.247 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.543 HD21 HG23 ' A' ' 68' ' ' VAL . 44.8 tp -63.48 -46.73 84.81 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.51 -0.768 . . . . 0.43 110.199 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.549 ' HG2' ' HB1' ' A' ' 65' ' ' ALA . 70.8 mtm -63.92 -33.95 76.87 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.392 -0.367 . . . . 1.49 111.129 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.9 -33.48 75.41 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 121.957 0.884 . . . . 1.88 109.032 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.573 ' HA ' ' CB ' ' A' ' 17' ' ' SER . 86.5 m -68.99 -62.21 1.47 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.747 -1.115 . . . . 0.45 108.845 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.456 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.77 -25.32 54.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.912 -1.04 . . . . 0.27 111.575 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -43.65 84.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 123.288 0.635 . . . . 0.33 110.668 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -66.38 -37.41 85.21 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.108 -0.951 . . . . 2.84 110.769 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.535 HD21 ' HB1' ' A' ' 13' ' ' ALA . 3.9 mm? -62.66 -43.7 98.14 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 122.315 0.246 . . . . 0.9 110.431 177.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 59' ' ' SER . 43.1 mt-10 -58.0 -48.15 80.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 123.67 0.606 . . . . 0.48 110.638 175.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 m -63.4 -53.96 44.25 Favored 'General case' 0 CA--C 1.559 1.29 0 CA-C-O 121.196 0.522 . . . . 1.19 112.282 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -62.3 -38.04 87.87 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.948 0.899 . . . . 3.07 112.938 -174.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -102.29 -1.24 31.49 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 114.098 1.148 . . . . 1.01 114.098 -177.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.79 52.14 52.58 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 111.195 -0.762 . . . . 0.93 111.195 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.56 HG22 ' H ' ' A' ' 59' ' ' SER . 7.4 p -136.18 178.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 108.287 -1.005 . . . . 1.16 108.287 -174.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.56 ' H ' HG22 ' A' ' 58' ' ' VAL . 7.0 p -138.59 137.33 36.87 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-O 121.032 0.444 . . . . 1.87 109.977 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.456 HD12 ' HB1' ' A' ' 49' ' ' ALA . 87.2 mt -113.53 132.74 22.39 Favored Pre-proline 0 C--N 1.293 -1.881 0 N-CA-C 108.628 -0.878 . . . . 0.57 108.628 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -61.71 123.36 12.53 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 122.196 1.93 . . . . 0.87 111.012 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -53.42 -31.74 46.6 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.315 1.046 . . . . 1.83 111.018 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.66 -49.16 69.63 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.853 -1.067 . . . . 2.34 111.04 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.691 HG11 ' HG ' ' A' ' 77' ' ' LEU . 40.9 t -72.88 -33.81 44.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 109.805 -0.443 . . . . 0.66 109.805 -176.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.549 ' HB1' ' HG2' ' A' ' 46' ' ' MET . . . -58.05 -24.43 58.35 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.979 0.733 . . . . 0.51 112.979 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.63 2.81 34.25 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.495 -0.86 . . . . 0.61 112.364 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -108.1 -9.54 15.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.298 0.481 . . . . 3.98 112.298 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.543 HG23 HD21 ' A' ' 45' ' ' LEU . 15.5 m -79.35 111.42 16.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 121.465 0.65 . . . . 0.44 111.448 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -91.87 -31.93 15.5 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-N 115.667 -0.697 . . . . 1.91 110.219 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.423 HG22 ' HG2' ' A' ' 34' ' ' ARG . 41.1 p -121.69 145.31 42.76 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 115.325 -0.852 . . . . 0.47 111.016 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.72 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 56.8 Cg_exo -55.83 -34.17 90.57 Favored 'Trans proline' 0 C--O 1.212 -0.78 0 C-N-CA 123.916 3.078 . . . . 0.32 113.214 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 3.5 ptp180 -51.8 -45.86 64.02 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.346 0.403 . . . . 1.48 111.804 176.12 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -64.54 -44.83 89.56 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.532 0.682 . . . . 2.13 110.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.84 -47.65 68.39 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.952 -1.022 . . . . 0.9 110.657 -177.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 40.8 tp -58.48 -51.77 68.45 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.635 0.374 . . . . 0.34 110.95 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -58.71 -38.54 78.53 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.324 0.39 . . . . 0.57 110.93 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.691 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -62.49 -49.81 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.444 -0.576 . . . . 1.96 109.444 178.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.6 mt -67.34 -36.87 77.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.455 -0.339 . . . . 0.55 110.248 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -61.79 -37.06 82.96 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.873 -0.418 . . . . 1.14 109.873 176.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.51 -37.13 78.15 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.68 -0.691 . . . . 0.53 111.944 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.19 -44.86 67.83 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.189 0.519 . . . . 0.6 109.957 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.8 mt -66.96 -20.55 65.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 1.42 111.692 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.01 -27.04 69.14 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.979 0.511 . . . . 0.85 110.898 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -93.0 -4.95 51.72 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.782 -0.644 . . . . 2.44 110.129 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -94.67 31.58 1.77 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.583 0.706 . . . . 2.12 110.2 -177.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.447 ' HA ' ' HG2' ' A' ' 1' ' ' MET . . . . . . . . 0 C--N 1.305 -1.34 0 N-CA-C 108.34 -0.985 . . . . 3.84 108.34 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 CA--C 1.506 -0.718 0 N-CA-C 109.098 -0.704 . . . . 6.63 109.098 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.58 -49.55 14.4 Favored 'General case' 0 N--CA 1.439 -0.993 0 N-CA-C 108.405 -0.961 . . . . 4.09 108.405 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.0 m -91.75 106.57 18.57 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 122.778 1.275 . . . . 2.77 109.021 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 29.8 tp -155.78 161.0 40.75 Favored 'General case' 0 N--CA 1.388 -3.55 0 N-CA-C 103.937 -2.616 . . . . 1.51 103.937 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.434 ' HG ' HD11 ' A' ' 82' ' ' LEU . 92.1 mt -89.53 123.05 33.28 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 108.82 -0.807 . . . . 0.8 108.82 178.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.7 p -101.87 -173.91 2.46 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 107.313 -1.365 . . . . 0.63 107.313 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.501 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.6 m -57.23 -42.47 81.45 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.153 -0.684 . . . . 0.61 109.153 173.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.28 -48.91 79.85 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.424 1.089 . . . . 1.65 110.821 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -68.79 -39.54 80.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 116.027 -0.533 . . . . 1.41 111.421 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.434 HD22 HD13 ' A' ' 75' ' ' LEU . 18.6 tp -67.01 -45.2 78.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.795 -0.638 . . . . 0.48 109.978 -177.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.551 ' HG3' ' HG ' ' A' ' 26' ' ' LEU . 43.8 ttp-105 -53.81 -45.78 70.91 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.559 -0.746 . . . . 2.46 109.882 177.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.545 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 66.9 mtp180 -55.84 -43.82 77.4 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.058 -0.974 . . . . 3.93 112.11 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.408 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -61.18 -45.43 94.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 123.73 0.644 . . . . 0.5 110.217 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 mp -65.52 -30.8 71.6 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.245 0.461 . . . . 1.44 112.245 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 11' ' ' ARG . 48.2 t -72.83 -34.69 47.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.156 -0.683 . . . . 0.8 109.156 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 44.2 mt-10 -66.19 -42.04 89.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.455 -0.338 . . . . 2.05 111.493 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.555 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 4.7 p -77.41 -42.02 37.77 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.896 1.073 . . . . 1.39 113.896 -177.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.43 -37.82 31.31 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 121.119 0.485 . . . . 1.58 110.785 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.06 178.05 44.73 Favored Glycine 0 N--CA 1.424 -2.15 0 N-CA-C 109.777 -1.329 . . . . 2.32 109.777 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.91 83.04 7.6 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.924 0.869 . . . . 5.17 110.085 177.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 38.4 p -79.93 -95.55 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.507 0 CA-C-N 114.796 -1.093 . . . . 4.86 109.591 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -87.39 -14.01 41.81 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.349 -1.352 . . . . 4.5 107.349 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.47 -25.04 29.47 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.431 -1.468 . . . . 2.77 109.431 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p 55.45 -175.42 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.597 1.959 . . . . 2.87 113.136 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -120.23 70.52 0.88 Allowed 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.136 -1.431 . . . . 3.23 107.136 171.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.551 ' HG ' ' HG3' ' A' ' 11' ' ' ARG . 15.1 tp -105.7 -17.14 14.48 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 113.598 -1.637 . . . . 1.16 107.904 -176.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.452 ' HA ' ' HD2' ' A' ' 11' ' ' ARG . 10.1 p -51.28 129.79 25.41 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 125.46 1.504 . . . . 1.46 112.881 -178.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.55 -116.24 4.58 Favored Glycine 0 N--CA 1.425 -2.087 0 CA-C-N 115.148 -0.933 . . . . 1.02 111.671 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.501 ' HA ' HG21 ' A' ' 7' ' ' THR . 3.8 m-20 -112.71 126.17 55.11 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.32 -0.993 . . . . 2.07 108.32 -175.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 14.9 p90 -128.86 11.81 6.15 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.734 -0.786 . . . . 0.44 111.348 -177.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.851 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 44.8 mt -53.02 -29.13 27.7 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.735 1.383 . . . . 0.39 114.735 -176.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -98.73 -6.08 30.18 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.964 0.411 . . . . 2.04 111.842 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.7 mp -82.33 124.51 30.05 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.807 -0.812 . . . . 1.37 108.807 178.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -76.04 143.58 41.32 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 116.47 -0.332 . . . . 3.94 110.855 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.443 ' HA ' HG12 ' A' ' 38' ' ' ILE . 77.2 m-85 -63.68 -44.1 94.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.463 -0.335 . . . . 0.35 111.014 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -57.95 -26.23 61.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.085 0.469 . . . . 2.79 111.75 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.46 -30.45 27.22 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.168 -0.469 . . . . 0.88 110.681 -176.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.443 HG12 ' HA ' ' A' ' 35' ' ' PHE . 33.9 pt -92.32 19.05 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 121.122 0.487 . . . . 0.6 112.06 -176.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.41 34.3 54.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.047 -0.597 . . . . 0.66 112.011 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -116.19 118.71 33.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 121.467 0.651 . . . . 1.33 112.162 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -85.82 151.14 24.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 106.939 -1.504 . . . . 1.06 106.939 172.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.401 ' O ' ' HG3' ' A' ' 46' ' ' MET . 32.7 p -55.0 -32.27 61.66 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.342 0.497 . . . . 1.03 112.342 176.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 tt -63.92 -50.08 70.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.659 -0.867 . . . . 1.56 108.659 176.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.56 -38.81 88.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.901 -0.59 . . . . 0.43 109.789 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.539 HD21 HG23 ' A' ' 68' ' ' VAL . 57.7 tp -61.72 -46.41 89.77 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.329 -0.851 . . . . 0.43 110.334 177.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.401 ' HG3' ' O ' ' A' ' 42' ' ' SER . 73.1 mtm -62.56 -37.39 85.97 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 116.456 -0.338 . . . . 1.49 111.278 177.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 29.8 tt0 -63.83 -35.47 80.74 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.539 0.685 . . . . 1.88 110.285 176.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.8 m -65.6 -53.25 44.35 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.227 -1.397 . . . . 0.45 107.227 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.439 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.83 -38.63 72.89 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.19 -1.368 . . . . 0.27 110.033 175.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.92 -44.99 91.43 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 123.96 0.904 . . . . 0.33 112.061 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 53.2 mtt180 -62.68 -38.78 91.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.701 -0.851 . . . . 2.84 108.701 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 13' ' ' ALA . 96.6 mt -65.87 -41.18 91.92 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.041 -0.981 . . . . 0.9 111.212 177.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -55.7 -55.32 33.54 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.086 -0.709 . . . . 0.48 109.086 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.8 m -62.42 -51.24 68.31 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.534 -1.212 . . . . 1.19 112.433 -177.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -65.77 -38.09 88.11 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.037 0.754 . . . . 3.07 113.037 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -100.29 3.63 43.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 114.121 1.156 . . . . 1.01 114.121 -175.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.27 52.16 51.5 Favored Glycine 0 N--CA 1.459 0.193 0 N-CA-C 111.501 -0.64 . . . . 0.93 111.501 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.462 HG22 ' H ' ' A' ' 59' ' ' SER . 8.6 p -141.57 177.41 3.43 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 N-CA-C 107.853 -1.165 . . . . 1.16 107.853 -176.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.462 ' H ' HG22 ' A' ' 58' ' ' VAL . 10.8 t -141.55 155.61 45.77 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 119.271 0.942 . . . . 1.87 108.819 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.439 HD12 ' HB1' ' A' ' 49' ' ' ALA . 73.4 mt -135.35 125.76 16.94 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 109.054 -0.721 . . . . 0.57 109.054 -176.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.13 124.84 16.85 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.115 2.543 . . . . 0.87 112.09 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.567 1.321 . . . . 1.83 114.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.578 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 15.3 t70 -71.03 -34.77 71.62 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.007 -0.677 . . . . 2.34 110.664 -176.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.39 -35.17 56.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.603 -0.888 . . . . 0.66 108.603 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -24.7 63.62 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.173 -0.921 . . . . 0.51 110.938 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.4 1.67 55.99 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.093 -0.575 . . . . 0.61 112.463 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 34.6 mmt180 -97.16 -17.58 19.81 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 122.243 -0.563 . . . . 3.98 110.3 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.539 HG23 HD21 ' A' ' 45' ' ' LEU . 30.6 m -76.43 109.94 11.16 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-O 122.045 0.926 . . . . 0.44 109.749 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -93.4 -30.83 14.89 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-N 115.033 -0.985 . . . . 1.91 109.224 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 32.9 p -118.76 136.0 23.99 Favored Pre-proline 0 N--CA 1.402 -2.841 0 CA-C-N 114.315 -1.311 . . . . 0.47 110.15 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.851 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 85.5 Cg_exo -50.58 -30.74 29.19 Favored 'Trans proline' 0 CA--C 1.51 -0.703 0 C-N-CA 124.218 3.279 . . . . 0.32 114.084 -178.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -51.72 -44.86 63.38 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 123.313 0.383 . . . . 1.48 110.891 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -67.89 -45.47 74.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 124.403 1.081 . . . . 2.13 110.03 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.515 HD23 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -66.62 -44.15 82.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.829 -1.078 . . . . 0.9 109.864 -176.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.434 HD13 HD22 ' A' ' 10' ' ' LEU . 42.8 tp -57.14 -52.64 64.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.309 -0.626 . . . . 0.34 109.309 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.27 -44.68 75.85 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.14 0.976 . . . . 0.57 111.706 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.47 -52.05 67.26 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 115.028 -0.987 . . . . 1.96 110.219 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 52.1 mt -69.4 -39.25 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.774 -0.648 . . . . 0.55 110.282 -178.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -55.98 -46.31 78.68 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.32 0.248 . . . . 1.14 111.122 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.02 -43.85 96.64 Favored Glycine 0 N--CA 1.445 -0.762 0 O-C-N 123.832 0.707 . . . . 0.53 111.545 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.78 -38.21 73.4 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 122.652 0.381 . . . . 0.6 111.565 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.434 HD11 ' HG ' ' A' ' 5' ' ' LEU . 68.5 mt -66.55 -35.14 79.51 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 122.452 0.301 . . . . 1.42 111.794 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.71 95.93 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.707 -0.679 . . . . 0.85 111.065 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.72 -45.86 12.91 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.423 0.527 . . . . 2.44 112.423 -178.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.93 69.35 10.77 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.726 0.774 . . . . 2.12 111.216 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.579 0 N-CA-C 107.692 -1.225 . . . . 3.84 107.692 -179.784 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 CA--C 1.501 -0.937 0 N-CA-C 107.987 -1.116 . . . . 6.63 107.987 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.21 121.18 29.31 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.817 -0.809 . . . . 4.09 108.817 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.605 HG22 ' HE1' ' A' ' 56' ' ' TYR . 5.6 m -93.75 106.77 18.72 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 105.983 -1.858 . . . . 2.77 105.983 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.1 tp -113.77 162.76 15.9 Favored 'General case' 0 N--CA 1.396 -3.134 0 CA-C-N 114.297 -1.319 . . . . 1.51 111.126 -168.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.74 HD21 HD22 ' A' ' 52' ' ' LEU . 68.9 mt -91.57 124.28 35.61 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 124.025 0.93 . . . . 0.8 111.317 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.4 p -97.52 -177.81 3.93 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.276 -1.379 . . . . 0.63 107.276 170.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.69 HG21 ' HA ' ' A' ' 29' ' ' ASP . 8.5 m -58.19 -41.72 84.57 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 109.209 -0.663 . . . . 0.61 109.209 174.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -65.44 -43.04 91.68 Favored 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 115.609 -0.723 . . . . 1.65 112.071 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' HB3' HD23 ' A' ' 5' ' ' LEU . 12.3 m-20 -64.91 -39.65 93.85 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.577 -0.527 . . . . 1.41 109.577 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.593 HD11 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -65.4 -56.26 13.54 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 114.785 -1.098 . . . . 0.48 109.424 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -49.18 -47.97 45.5 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.693 1.197 . . . . 2.46 111.18 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -56.65 -46.16 81.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.853 -1.067 . . . . 3.93 111.154 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.67 77.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.466 -0.788 . . . . 0.5 111.736 -176.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.412 HD13 HG21 ' A' ' 48' ' ' THR . 4.0 mm? -63.74 -57.16 10.82 Favored 'General case' 0 C--O 1.246 0.895 0 N-CA-C 109.298 -0.63 . . . . 1.44 109.298 175.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -54.48 -50.34 58.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-N 114.916 -1.038 . . . . 0.8 111.317 -175.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -61.05 -30.07 70.11 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.268 0.47 . . . . 2.05 112.268 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.3 m -80.27 -42.78 22.49 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.041 0.448 . . . . 1.39 112.065 -177.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.555 ' HB3' ' HG2' ' A' ' 20' ' ' GLU . . . -74.5 -32.4 62.51 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.209 0.528 . . . . 1.58 110.401 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.68 25.45 42.11 Favored Glycine 0 CA--C 1.493 -1.307 0 N-CA-C 110.857 -0.897 . . . . 2.32 110.857 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.555 ' HG2' ' HB3' ' A' ' 18' ' ' ALA . 41.8 mm-40 -71.26 136.19 47.82 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.495 -0.853 . . . . 5.17 111.689 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.8 p -77.26 -71.65 0.4 Allowed 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.062 -1.459 . . . . 4.86 107.062 170.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.26 -64.14 1.04 Allowed 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.598 -0.728 . . . . 4.5 109.55 175.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.45 ' O ' ' HB ' ' A' ' 24' ' ' THR . . . 64.52 34.39 89.79 Favored Glycine 0 CA--C 1.474 -2.529 0 CA-C-N 115.777 -0.647 . . . . 2.77 114.652 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 23' ' ' GLY . 53.9 m 74.01 154.28 0.15 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 124.348 0.675 . . . . 2.87 109.702 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.76 96.95 2.62 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.541 -1.281 . . . . 3.23 107.541 174.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.0 tp -112.95 2.86 15.97 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.731 -0.668 . . . . 1.16 110.205 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 p -72.85 100.35 2.88 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.53 -0.759 . . . . 1.46 111.764 -179.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 146.87 -167.89 28.19 Favored Glycine 0 C--O 1.259 1.665 0 N-CA-C 109.124 -1.59 . . . . 1.02 109.124 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.69 ' HA ' HG21 ' A' ' 7' ' ' THR . 8.4 m-20 -89.17 98.48 11.79 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.73 -0.841 . . . . 2.07 108.73 176.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -94.34 18.94 10.21 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.373 -0.831 . . . . 0.44 111.436 -174.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.718 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 63.4 mt -53.7 -24.93 16.2 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.197 1.184 . . . . 0.39 114.197 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.18 -19.56 19.96 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.22 0.533 . . . . 2.04 110.812 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.8 mt -80.36 128.34 33.44 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.715 -0.675 . . . . 1.37 109.887 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.72 155.37 35.69 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.126 -0.488 . . . . 3.94 109.996 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -67.1 -44.14 80.75 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 120.872 -0.331 . . . . 0.35 110.432 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.2 -24.64 64.97 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.6 0.714 . . . . 2.79 110.533 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.78 -30.73 40.76 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.462 -0.79 . . . . 0.88 110.057 -177.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.5 pt -98.33 13.11 4.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 112.126 0.417 . . . . 0.6 112.126 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.02 48.96 18.22 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 115.881 -0.599 . . . . 0.66 112.91 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -134.37 118.33 17.33 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.699 0.629 . . . . 1.33 112.699 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -91.04 161.52 15.09 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.073 -0.512 . . . . 1.06 109.888 172.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.496 ' O ' ' HG3' ' A' ' 46' ' ' MET . 56.0 p -54.98 -29.44 56.99 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.476 1.287 . . . . 1.03 114.476 -179.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.11 -50.82 64.58 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 117.991 0.36 . . . . 1.56 110.424 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.98 86.71 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.68 0.752 . . . . 0.43 109.637 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.659 ' O ' ' HB ' ' A' ' 48' ' ' THR . 29.8 tp -63.87 -40.63 97.0 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.706 -1.134 . . . . 0.43 110.989 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.5 mtm -64.58 -37.06 86.26 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 121.774 -0.579 . . . . 1.49 112.02 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.73 -28.58 68.54 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.103 0.954 . . . . 1.88 109.829 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.659 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 62.5 m -64.89 -53.84 40.18 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.57 -1.641 . . . . 0.45 106.57 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.496 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -56.49 -36.21 68.87 Favored 'General case' 0 C--O 1.205 -1.287 0 CA-C-N 114.341 -1.299 . . . . 0.27 110.041 174.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.77 -40.76 80.53 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 122.917 0.487 . . . . 0.33 112.032 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.1 mtp85 -64.79 -39.3 93.37 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.654 0.74 . . . . 2.84 109.159 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.74 HD22 HD21 ' A' ' 5' ' ' LEU . 64.4 mt -65.27 -44.67 87.28 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.429 -1.26 . . . . 0.9 109.413 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 42.8 mt-10 -55.97 -50.55 70.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.541 -0.754 . . . . 0.48 110.227 176.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.1 m -62.99 -49.55 74.26 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.659 -0.701 . . . . 1.19 112.025 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -63.68 -44.06 94.83 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.446 0.536 . . . . 3.07 112.446 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.605 ' HE1' HG22 ' A' ' 3' ' ' THR . 62.6 m-85 -94.65 -7.45 40.8 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.08 0.77 . . . . 1.01 113.08 -173.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 69.39 51.54 26.25 Favored Glycine 0 C--O 1.24 0.483 0 N-CA-C 111.298 -0.721 . . . . 0.93 111.298 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 59' ' ' SER . 11.0 p -141.3 176.86 4.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 N-CA-C 107.62 -1.252 . . . . 1.16 107.62 -176.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.416 ' H ' HG22 ' A' ' 58' ' ' VAL . 17.7 t -139.06 132.23 29.78 Favored 'General case' 0 N--CA 1.424 -1.755 0 N-CA-C 108.433 -0.951 . . . . 1.87 108.433 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' HB1' ' A' ' 49' ' ' ALA . 67.0 mt -104.59 123.14 41.25 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.003 -0.999 . . . . 0.57 108.933 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.532 ' HB2' HG23 ' A' ' 64' ' ' VAL . 36.9 Cg_exo -58.79 118.28 5.14 Favored 'Trans proline' 0 C--O 1.25 1.11 0 C-N-CA 122.373 2.049 . . . . 0.87 110.413 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.92 -26.87 38.94 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.699 0.799 . . . . 1.83 112.759 -176.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.96 -28.92 65.95 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 116.114 -0.493 . . . . 2.34 110.749 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.532 HG23 ' HB2' ' A' ' 61' ' ' PRO . 67.2 t -76.99 -48.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 N-CA-C 108.509 -0.923 . . . . 0.66 108.509 177.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.66 -30.74 63.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.955 -1.02 . . . . 0.51 112.097 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -89.15 -5.19 73.41 Favored Glycine 0 N--CA 1.439 -1.127 0 C-N-CA 120.051 -1.071 . . . . 0.61 113.009 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -98.53 -14.99 19.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.97 0.73 . . . . 3.98 112.97 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.53 HG21 HD23 ' A' ' 74' ' ' LEU . 26.7 m -79.66 121.56 33.18 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 CA-C-O 121.09 0.472 . . . . 0.44 110.933 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -93.16 -39.08 11.23 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.629 0.728 . . . . 1.91 110.911 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.45 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 34.9 p -115.42 138.47 23.73 Favored Pre-proline 0 N--CA 1.413 -2.316 0 CA-C-N 115.369 -0.832 . . . . 0.47 110.739 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.718 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 74.1 Cg_exo -52.75 -29.73 43.56 Favored 'Trans proline' 0 CA--C 1.508 -0.787 0 C-N-CA 124.34 3.36 . . . . 0.32 113.729 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -51.36 -44.93 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 123.439 0.462 . . . . 1.48 110.581 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 31.8 mt-10 -66.82 -49.28 66.29 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 123.982 0.913 . . . . 2.13 109.786 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.593 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -64.71 -43.61 92.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.743 -1.117 . . . . 0.9 110.193 -175.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' OD1' ' A' ' 79' ' ' ASN . 43.9 tp -57.28 -56.96 15.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 123.667 0.604 . . . . 0.34 109.98 178.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.66 -45.03 93.25 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 112.888 0.699 . . . . 0.57 112.888 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 73' ' ' GLU . 87.0 mt -61.77 -37.66 85.14 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 112.115 0.413 . . . . 1.96 112.115 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 64.7 mt -80.72 -35.57 14.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 C-N-CA 120.23 -0.588 . . . . 0.55 109.977 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.404 ' OD1' ' HG ' ' A' ' 75' ' ' LEU . 11.7 m120 -57.74 -40.94 80.84 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 110.383 -0.228 . . . . 1.14 110.383 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.405 ' O ' ' HG2' ' A' ' 84' ' ' GLU . . . -61.61 -40.8 99.22 Favored Glycine 0 N--CA 1.45 -0.375 0 O-C-N 123.613 0.57 . . . . 0.53 112.033 176.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.27 -30.79 68.98 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.179 0.514 . . . . 0.6 110.458 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 86.6 mt -77.19 -34.19 56.26 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.719 -0.673 . . . . 1.42 110.444 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.0 74.8 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.237 0.542 . . . . 0.85 110.777 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 80' ' ' GLY . 11.9 pt-20 -94.84 14.82 20.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.77 -0.65 . . . . 2.44 111.038 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -93.67 161.3 14.4 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.188 -1.041 . . . . 2.12 108.188 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.707 0 N-CA-C 108.885 -0.783 . . . . 3.84 108.885 -176.574 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 mmt . . . . . 0 CA--C 1.497 -1.092 0 N-CA-C 107.131 -1.433 . . . . 6.63 107.131 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.46 -23.38 27.85 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.235 -1.394 . . . . 4.09 107.235 173.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.2 m -119.77 106.42 12.09 Favored 'General case' 0 N--CA 1.417 -2.118 0 CA-C-N 114.1 -1.409 . . . . 2.77 107.217 176.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.3 mp 63.0 -175.46 0.15 Allowed 'General case' 0 C--O 1.25 1.081 0 N-CA-C 115.012 1.486 . . . . 1.51 115.012 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.493 HD11 HD22 ' A' ' 52' ' ' LEU . 82.3 mt -113.86 132.9 55.73 Favored 'General case' 0 CA--C 1.491 -1.319 0 CA-C-N 113.718 -1.583 . . . . 0.8 108.431 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.8 p -99.8 -174.78 2.79 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 108.909 -0.775 . . . . 0.63 108.909 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -57.75 -45.81 85.38 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.418 0.627 . . . . 0.61 109.31 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -61.18 -42.35 98.42 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 114.789 -1.096 . . . . 1.65 110.636 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.83 -40.73 88.1 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 115.666 -0.697 . . . . 1.41 111.413 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.417 HD11 HD12 ' A' ' 74' ' ' LEU . 15.9 tp -63.85 -38.44 91.1 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.539 -0.755 . . . . 0.48 109.31 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.523 ' O ' HG23 ' A' ' 15' ' ' VAL . 39.8 ttm105 -56.12 -54.35 46.17 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.526 -0.761 . . . . 2.46 109.998 173.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 8.6 tpt180 -57.43 -34.68 69.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 115.645 -0.707 . . . . 3.93 111.379 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.96 75.46 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.289 0.368 . . . . 0.5 110.275 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' OH ' ' A' ' 40' ' ' TYR . 10.6 mp -67.02 -24.28 66.0 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.116 0.413 . . . . 1.44 112.116 177.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 11' ' ' ARG . 97.2 t -68.46 -45.99 81.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.979 -0.749 . . . . 0.8 108.979 175.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 14.4 mm-40 -62.66 -44.95 94.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.698 -0.683 . . . . 2.05 112.829 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.569 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 3.9 p -71.48 -30.62 66.19 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 112.64 0.608 . . . . 1.39 112.64 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.93 -57.22 3.97 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.375 0.607 . . . . 1.58 109.787 177.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.61 -129.11 9.77 Favored Glycine 0 N--CA 1.422 -2.278 0 N-CA-C 110.712 -0.955 . . . . 2.32 110.712 -177.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -91.8 13.44 18.28 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 120.837 0.351 . . . . 5.17 111.459 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.4 p -88.66 27.53 1.28 Allowed 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.688 0.756 . . . . 4.86 112.224 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 68.1 -61.28 0.39 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.121 1.769 . . . . 4.5 113.554 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.57 21.47 59.99 Favored Glycine 0 C--N 1.318 -0.461 0 N-CA-C 109.814 -1.314 . . . . 2.77 109.814 -173.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.4 p 61.6 -169.57 0.17 Allowed 'General case' 0 C--O 1.244 0.79 0 C-N-CA 126.598 1.959 . . . . 2.87 111.593 -176.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -84.12 105.76 15.23 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.022 -1.103 . . . . 3.23 108.022 175.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.6 tp -117.28 18.82 14.36 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.367 -0.833 . . . . 1.16 110.802 -171.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.7 m -70.1 143.94 52.26 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.786 -0.643 . . . . 1.46 110.753 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.78 -156.33 34.53 Favored Glycine 0 N--CA 1.442 -0.958 0 N-CA-C 110.796 -0.922 . . . . 1.02 110.796 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.82 134.8 33.9 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.551 -0.907 . . . . 2.07 108.551 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.485 ' HB2' HD12 ' A' ' 33' ' ' LEU . 18.6 p90 -126.48 20.33 7.31 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.896 -0.593 . . . . 0.44 109.947 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.768 ' HB3' ' HB2' ' A' ' 72' ' ' ARG . 22.2 mt -53.85 -31.31 49.02 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.144 1.164 . . . . 0.39 114.144 -178.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -95.63 -6.63 39.71 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.94 0.4 . . . . 2.04 111.24 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 30' ' ' PHE . 65.0 mt -82.18 109.96 16.95 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 106.796 -1.557 . . . . 1.37 106.796 176.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HD2' ' OD1' ' A' ' 69' ' ' ASP . 32.5 mtm105 -72.08 152.77 42.13 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.457 -0.571 . . . . 3.94 109.457 -173.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.63 -46.75 86.83 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.567 -0.531 . . . . 0.35 109.567 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -57.98 -23.28 53.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.814 0.446 . . . . 2.79 111.956 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -83.14 -28.74 29.19 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.165 0.507 . . . . 0.88 110.702 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.4 pt -97.24 13.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.303 0.573 . . . . 0.6 112.097 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.24 32.17 32.35 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.928 -0.653 . . . . 0.66 112.774 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.436 ' OH ' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-85 -115.97 105.48 12.7 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.169 0.509 . . . . 1.33 111.388 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -83.3 158.6 22.15 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.766 -1.198 . . . . 1.06 107.766 176.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.62 ' O ' ' HG3' ' A' ' 46' ' ' MET . 53.5 p -52.19 -31.08 30.0 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.377 0.88 . . . . 1.03 113.377 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.1 -51.32 64.57 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 120.982 0.42 . . . . 1.56 110.069 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.32 84.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.386 0.612 . . . . 0.43 109.886 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.492 HD21 HG23 ' A' ' 68' ' ' VAL . 52.9 tp -61.88 -45.44 93.75 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.43 110.717 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.62 ' HG3' ' O ' ' A' ' 42' ' ' SER . 54.0 mtt -62.81 -39.32 93.91 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 110.247 -0.279 . . . . 1.49 110.247 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -62.37 -37.64 86.48 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.768 0.795 . . . . 1.88 108.921 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.423 HG21 HD12 ' A' ' 14' ' ' LEU . 83.8 m -67.99 -57.63 5.85 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.502 -1.227 . . . . 0.45 108.082 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.521 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.06 -32.38 66.17 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 114.532 -1.213 . . . . 0.27 111.033 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.58 83.61 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.477 0.711 . . . . 0.33 111.721 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.569 ' NH2' ' HA ' ' A' ' 17' ' ' SER . 75.0 mtt180 -66.53 -39.9 88.85 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.84 -1.073 . . . . 2.84 109.064 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.493 HD22 HD11 ' A' ' 5' ' ' LEU . 90.3 mt -64.86 -40.56 95.35 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.143 -0.935 . . . . 0.9 110.029 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -56.3 -55.29 35.14 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.66 -0.7 . . . . 0.48 109.641 174.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.0 t -63.14 -44.38 95.69 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 115.096 -0.957 . . . . 1.19 111.731 -176.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.13 -49.6 71.51 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.817 0.673 . . . . 3.07 112.817 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.425 ' HB3' HD11 ' A' ' 82' ' ' LEU . 80.8 m-85 -94.13 -6.72 44.29 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 114.35 1.241 . . . . 1.01 114.35 -172.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.64 52.88 6.89 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.779 -1.2 . . . . 0.93 111.301 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.556 ' HB ' HD13 ' A' ' 82' ' ' LEU . 12.0 p -138.95 176.9 5.53 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 106.352 -1.721 . . . . 1.16 106.352 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 58' ' ' VAL . 17.1 t -141.7 145.08 34.46 Favored 'General case' 0 N--CA 1.415 -2.198 0 N-CA-C 108.712 -0.847 . . . . 1.87 108.712 177.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.521 HD12 ' HB1' ' A' ' 49' ' ' ALA . 64.4 mt -131.97 111.37 14.5 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.451 -1.314 . . . . 0.57 107.451 -178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.474 ' HB2' HG23 ' A' ' 64' ' ' VAL . 37.5 Cg_exo -62.02 128.97 25.67 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.7 2.267 . . . . 0.87 111.039 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 9.4 p-10 -55.06 -30.06 58.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.393 1.077 . . . . 1.83 112.48 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -68.36 -35.76 78.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.334 -0.617 . . . . 2.34 109.334 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.474 HG23 ' HB2' ' A' ' 61' ' ' PRO . 25.3 t -76.88 -47.68 27.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 108.382 -0.97 . . . . 0.66 108.382 176.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.15 -29.32 63.52 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 123.516 0.727 . . . . 0.51 112.509 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 42' ' ' SER . . . -85.55 -2.51 87.07 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.66 -0.781 . . . . 0.61 112.953 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -100.18 -24.62 14.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.639 0.219 . . . . 3.98 111.341 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG23 HD21 ' A' ' 45' ' ' LEU . 12.3 m -73.61 120.4 22.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.975 0.893 . . . . 0.44 111.728 -175.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 28.4 t70 -91.59 -47.48 7.38 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-N 114.233 -1.349 . . . . 1.91 112.386 -175.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 41.1 p -107.85 143.18 26.79 Favored Pre-proline 0 N--CA 1.408 -2.56 0 CA-C-N 116.014 -0.539 . . . . 0.47 110.91 -177.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.625 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 79.5 Cg_exo -53.74 -31.24 60.22 Favored 'Trans proline' 0 C--O 1.211 -0.839 0 C-N-CA 123.655 2.903 . . . . 0.32 111.706 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.768 ' HB2' ' HB3' ' A' ' 31' ' ' LEU . 25.0 ttp85 -51.4 -53.33 37.75 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 123.761 0.663 . . . . 1.48 111.03 174.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.84 -39.78 87.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.25 -0.432 . . . . 2.13 111.049 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.444 HD23 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -68.16 -44.85 75.05 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.406 -0.361 . . . . 0.9 111.207 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.2 tp -56.99 -50.06 73.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.22 -0.659 . . . . 0.34 109.22 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.54 -37.71 88.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.179 -0.918 . . . . 0.57 111.635 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.445 HD11 HG12 ' A' ' 64' ' ' VAL . 5.1 tt -58.3 -52.35 65.97 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 108.835 -0.802 . . . . 1.96 108.835 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.5 mt -64.56 -50.7 74.71 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 N-CA-C 109.131 -0.692 . . . . 0.55 109.131 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -51.2 -44.05 61.5 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.547 0.53 . . . . 1.14 111.871 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 84' ' ' GLU . . . -68.55 -48.73 48.79 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 121.237 -0.506 . . . . 0.53 112.456 178.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.92 79.41 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.122 0.487 . . . . 0.6 111.276 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.556 HD13 ' HB ' ' A' ' 58' ' ' VAL . 17.5 tp -70.95 -33.32 70.37 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.707 -0.679 . . . . 1.42 110.248 -177.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.95 68.86 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.899 0.38 . . . . 0.85 111.212 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 80' ' ' GLY . 34.4 mm-40 -77.48 -21.32 52.99 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.867 -0.606 . . . . 2.44 111.541 -179.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.78 136.64 38.15 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.205 -0.452 . . . . 2.12 109.881 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.469 0 N-CA-C 108.335 -0.987 . . . . 3.84 108.335 178.561 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.428 ' HA ' ' OXT' ' A' ' 86' ' ' ALA . 56.2 ttp . . . . . 0 CA--C 1.509 -0.631 0 N-CA-C 108.333 -0.988 . . . . 6.63 108.333 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.9 108.74 1.26 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.026 -0.731 . . . . 4.09 109.026 175.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.5 t -71.88 126.29 29.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.288 1.042 . . . . 2.77 110.077 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.4 tp -68.68 154.42 41.96 Favored 'General case' 0 N--CA 1.409 -2.519 0 CA-C-N 113.827 -1.533 . . . . 1.51 109.564 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.37 124.58 48.19 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.318 -0.623 . . . . 0.8 109.318 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.7 p -104.26 -170.82 1.82 Allowed 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.727 -1.212 . . . . 0.63 107.727 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.823 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.9 m -56.07 -49.55 73.48 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.152 0.501 . . . . 0.61 110.035 177.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.32 -43.3 88.12 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 114.89 -1.05 . . . . 1.65 110.267 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.13 -43.2 78.87 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.594 -0.73 . . . . 1.41 110.814 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.585 HD11 HD12 ' A' ' 74' ' ' LEU . 14.3 tp -65.19 -38.16 89.59 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.121 -0.945 . . . . 0.48 109.946 -175.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.796 ' HG3' ' HB3' ' A' ' 26' ' ' LEU . 36.8 ttp180 -51.01 -52.65 40.8 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.203 -0.908 . . . . 2.46 110.39 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.635 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 79.0 ttt180 -57.69 -42.77 84.34 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.021 -0.536 . . . . 3.93 111.982 -177.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.21 84.66 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.151 0.282 . . . . 0.5 110.663 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.605 HD23 HG21 ' A' ' 48' ' ' THR . 97.2 mt -65.85 -41.73 91.35 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.941 -0.572 . . . . 1.44 110.17 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 11' ' ' ARG . 57.3 t -61.59 -49.97 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.198 0.599 . . . . 0.8 110.111 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.635 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 48.1 mm-40 -57.35 -45.43 84.35 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.728 -0.669 . . . . 2.05 109.845 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.8 m -74.97 -19.47 60.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.456 -0.793 . . . . 1.39 112.547 -175.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.79 -13.37 42.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.514 0.673 . . . . 1.58 109.589 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.91 -69.98 2.36 Favored Glycine 0 CA--C 1.494 -1.22 0 N-CA-C 110.293 -1.123 . . . . 2.32 110.293 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -136.11 118.21 15.42 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 105.558 -2.016 . . . . 5.17 105.558 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.607 HG22 ' H ' ' A' ' 23' ' ' GLY . 11.2 m -113.8 133.07 55.62 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.946 -0.39 . . . . 4.86 109.946 -173.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.19 -23.56 65.77 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.793 0.806 . . . . 4.5 109.713 176.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.607 ' H ' HG22 ' A' ' 21' ' ' THR . . . 124.29 -44.25 1.3 Allowed Glycine 0 N--CA 1.424 -2.148 0 CA-C-N 114.858 -1.064 . . . . 2.77 110.711 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.1 p 51.54 35.17 13.86 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.736 1.215 . . . . 2.87 112.705 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.7 t70 57.34 36.94 27.81 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.281 1.432 . . . . 3.23 111.832 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.796 ' HB3' ' HG3' ' A' ' 11' ' ' ARG . 6.6 mp -82.76 -8.87 59.56 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.7 -0.682 . . . . 1.16 111.207 175.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 127.64 33.57 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.714 -0.675 . . . . 1.46 109.471 177.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.57 -129.48 9.92 Favored Glycine 0 N--CA 1.432 -1.579 0 N-CA-C 111.39 -0.684 . . . . 1.02 111.39 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.823 ' HA ' HG21 ' A' ' 7' ' ' THR . 29.0 t70 -121.6 116.38 24.51 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 108.898 -0.778 . . . . 2.07 108.898 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -121.86 22.2 10.47 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.96 -0.564 . . . . 0.44 111.142 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 55.6 mt -52.55 -19.47 2.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.417 1.636 . . . . 0.39 115.417 -177.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -92.97 -19.7 21.35 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.403 0.144 . . . . 2.04 111.345 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.23 122.22 26.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 1.37 110.281 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.531 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 34.6 mtm105 -77.8 145.85 36.14 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.962 -0.563 . . . . 3.94 109.798 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.56 ' HA ' HG12 ' A' ' 38' ' ' ILE . 46.6 m-85 -61.97 -42.08 98.73 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.582 -0.281 . . . . 0.35 110.795 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.94 -38.59 70.53 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.381 0.61 . . . . 2.79 110.24 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.11 -22.55 42.02 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.43 -0.805 . . . . 0.88 111.069 -173.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.6 pt -92.3 13.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.751 0.786 . . . . 0.6 110.55 177.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.91 87.5 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.571 -0.74 . . . . 0.66 113.81 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -81.83 131.86 35.27 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 112.189 0.441 . . . . 1.33 112.189 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.14 142.46 30.34 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.216 -1.772 . . . . 1.06 106.216 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 46' ' ' MET . 33.7 p -54.12 -31.98 53.76 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.522 0.934 . . . . 1.03 113.522 179.06 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.2 tp -64.68 -42.1 95.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.89 0.376 . . . . 1.56 110.234 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.62 -36.37 84.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.506 0.669 . . . . 0.43 109.709 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.505 HD21 HG23 ' A' ' 68' ' ' VAL . 54.7 tp -63.92 -45.23 90.2 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.205 -0.907 . . . . 0.43 109.931 176.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 42' ' ' SER . 83.3 mtp -61.89 -38.28 87.75 Favored 'General case' 0 C--O 1.196 -1.714 0 CA-C-N 115.931 -0.577 . . . . 1.49 110.258 176.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.8 tp10 -60.96 -35.2 76.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.806 0.842 . . . . 1.88 109.871 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.605 HG21 HD23 ' A' ' 14' ' ' LEU . 87.3 m -66.61 -57.33 7.44 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.566 -1.272 . . . . 0.45 107.566 -178.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.525 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.12 -43.61 74.26 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 113.725 -1.58 . . . . 0.27 109.567 177.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.07 91.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.75 0.82 . . . . 0.33 113.038 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 84.1 mtt180 -66.47 -38.27 86.96 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.23 -0.441 . . . . 2.84 109.989 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.62 -38.05 89.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.872 -0.604 . . . . 0.9 109.926 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.525 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -57.29 -55.12 38.83 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.642 -0.503 . . . . 0.48 109.642 173.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 59.2 p -61.19 -38.06 85.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.679 0.612 . . . . 1.19 112.504 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -71.01 -46.27 62.48 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.63 0.974 . . . . 3.07 113.63 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -101.74 -13.97 17.53 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 114.697 1.369 . . . . 1.01 114.697 -172.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.5 40.32 Favored Glycine 0 C--N 1.308 -0.986 0 C-N-CA 120.099 -1.048 . . . . 0.93 110.885 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.48 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 4.1 p -97.09 135.31 31.68 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 N-CA-C 109.126 -0.694 . . . . 1.16 109.126 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 m -96.77 106.07 18.3 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 109.92 -0.4 . . . . 1.87 109.92 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.408 ' CD1' ' HB1' ' A' ' 49' ' ' ALA . 67.9 mt -102.19 117.45 61.25 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 110.362 -0.236 . . . . 0.57 110.362 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.78 131.21 26.78 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.222 1.948 . . . . 0.87 110.329 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -51.88 -34.1 39.62 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.634 0.976 . . . . 1.83 113.634 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.634 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 3.4 m-20 -66.44 -45.62 79.22 Favored 'General case' 0 CA--C 1.495 -1.15 0 CA-C-O 120.566 0.222 . . . . 2.34 110.777 -178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.5 t -71.27 -31.68 44.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.538 -0.542 . . . . 0.66 109.538 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.82 -22.51 58.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.911 -0.586 . . . . 0.51 112.228 177.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.61 0.84 27.65 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 120.553 -0.832 . . . . 0.61 111.923 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 4.6 mmp_? -96.41 -15.11 21.98 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.185 -0.672 . . . . 3.98 109.185 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.525 HG21 HD23 ' A' ' 74' ' ' LEU . 19.5 m -76.85 91.84 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 CA-C-O 122.559 1.171 . . . . 0.44 109.641 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.531 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 18.9 t70 -86.23 -35.57 19.94 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 114.417 -1.265 . . . . 1.91 111.375 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.479 HG22 ' HG2' ' A' ' 34' ' ' ARG . 45.0 p -113.75 149.17 41.33 Favored Pre-proline 0 C--N 1.284 -2.255 0 N-CA-C 109.355 -0.609 . . . . 0.47 109.355 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.477 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.6 Cg_exo -52.27 -39.99 71.01 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.561 2.841 . . . . 0.32 112.949 -178.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.9 ptp85 -50.86 -40.94 57.42 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 123.715 0.634 . . . . 1.48 112.52 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.01 -52.6 58.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.059 0.457 . . . . 2.13 110.802 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.585 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -67.86 -42.05 81.94 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.083 -0.962 . . . . 0.9 109.99 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' OD1' ' A' ' 79' ' ' ASN . 32.9 tp -56.41 -57.02 14.08 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.524 -0.762 . . . . 0.34 109.321 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.73 -39.2 80.17 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.926 -0.579 . . . . 0.57 112.253 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.04 -46.45 89.49 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.214 0.53 . . . . 1.96 109.633 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.44 -36.73 20.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-N 116.069 -0.514 . . . . 0.55 110.292 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.404 ' OD1' ' HG ' ' A' ' 75' ' ' LEU . 11.4 m120 -56.96 -47.03 81.69 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.223 0.209 . . . . 1.14 110.95 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.53 -39.68 97.67 Favored Glycine 0 N--CA 1.447 -0.592 0 O-C-N 123.552 0.533 . . . . 0.53 112.155 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.37 75.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.023 0.44 . . . . 0.6 110.518 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.9 mt -68.24 -33.97 75.36 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.97 -0.559 . . . . 1.42 110.691 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.66 -27.34 69.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.428 0.691 . . . . 0.85 111.917 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -84.33 -5.9 59.32 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.519 -0.473 . . . . 2.44 111.4 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -115.06 176.25 5.14 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 108.654 -0.869 . . . . 2.12 108.654 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.428 ' OXT' ' HA ' ' A' ' 1' ' ' MET . . . . . . . . 0 C--N 1.29 -2.009 0 N-CA-C 107.38 -1.341 . . . . 3.84 107.38 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tpt . . . . . 0 CA--C 1.516 -0.333 0 N-CA-C 109.693 -0.484 . . . . 6.63 109.693 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.441 ' HB3' ' HE1' ' A' ' 56' ' ' TYR . . . -144.0 136.53 26.92 Favored 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 108.389 -0.967 . . . . 4.09 108.389 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -72.92 106.51 4.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.569 0.699 . . . . 2.77 110.164 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 72.71 173.77 0.3 Allowed 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 113.81 -1.541 . . . . 1.51 112.641 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.492 HD22 ' OD1' ' A' ' 9' ' ' ASP . 88.3 mt -126.52 147.45 49.84 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 108.672 -0.862 . . . . 0.8 108.672 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.8 p -99.43 172.78 7.11 Favored 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 107.372 -1.344 . . . . 0.63 107.372 174.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.708 HG21 ' HA ' ' A' ' 29' ' ' ASP . 21.0 m -58.9 -31.25 68.44 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.278 -0.638 . . . . 0.61 109.278 172.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -66.02 -50.68 63.37 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.356 -0.838 . . . . 1.65 111.716 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.492 ' OD1' HD22 ' A' ' 5' ' ' LEU . 15.4 t70 -68.44 -37.8 80.57 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.347 -0.541 . . . . 1.41 109.909 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 75' ' ' LEU . 18.4 tp -62.67 -42.95 99.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.28 -0.873 . . . . 0.48 108.984 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 15' ' ' VAL . 42.2 ttp180 -50.35 -38.19 40.83 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 124.507 1.123 . . . . 2.46 111.12 178.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.694 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 59.6 ttt180 -56.25 -51.39 68.28 Favored 'General case' 0 C--O 1.216 -0.665 0 O-C-N 123.592 0.557 . . . . 3.93 110.724 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.45 -37.17 84.85 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 123.379 0.424 . . . . 0.5 111.909 -174.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.52 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.84 -29.66 69.64 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.312 -0.404 . . . . 1.44 111.296 176.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 11' ' ' ARG . 61.8 t -77.67 -39.97 27.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.401 -0.592 . . . . 0.8 109.401 176.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.694 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 6.7 mm-40 -55.99 -53.18 60.01 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.015 0.926 . . . . 2.05 110.655 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -77.03 -18.45 58.11 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.552 -0.749 . . . . 1.39 111.866 -174.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.88 -51.66 6.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.004 0.43 . . . . 1.58 109.999 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.36 -89.27 0.51 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.87 -1.292 . . . . 2.32 109.87 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -125.44 99.43 6.03 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 122.036 0.922 . . . . 5.17 110.852 177.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.3 m -133.66 -89.4 0.39 Allowed 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 104.81 -2.293 . . . . 4.86 104.81 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -171.62 132.51 0.75 Allowed 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 124.247 1.019 . . . . 4.5 108.288 170.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.69 78.89 1.29 Allowed Glycine 0 CA--C 1.455 -3.709 0 N-CA-C 108.634 -1.787 . . . . 2.77 108.634 175.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 m -69.36 73.78 0.34 Allowed 'General case' 0 N--CA 1.412 -2.374 0 CA-C-N 113.54 -1.33 . . . . 2.87 111.941 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.1 t70 61.57 39.01 15.14 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.435 1.494 . . . . 3.23 110.92 178.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.3 mp -77.85 -16.52 58.24 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.376 -0.829 . . . . 1.16 110.868 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -59.96 133.7 56.34 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.45 -0.795 . . . . 1.46 109.77 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.3 -106.87 3.21 Favored Glycine 0 N--CA 1.429 -1.791 0 N-CA-C 111.045 -0.822 . . . . 1.02 111.045 -176.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.708 ' HA ' HG21 ' A' ' 7' ' ' THR . 12.0 t70 -129.85 137.46 50.46 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.049 -1.093 . . . . 2.07 108.049 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.439 ' CZ ' ' HG ' ' A' ' 14' ' ' LEU . 11.8 p90 -137.66 20.13 2.89 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.793 -0.363 . . . . 0.44 110.177 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.743 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 75.7 mt -54.98 -22.42 15.19 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.15 0.796 . . . . 0.39 113.15 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -92.12 -14.59 28.94 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.733 0.813 . . . . 2.04 111.0 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 30' ' ' PHE . 4.0 mm? -80.11 131.77 35.81 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 115.891 -0.595 . . . . 1.37 109.978 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.645 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 14.3 mmt180 -76.65 137.56 39.51 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.371 -0.603 . . . . 3.94 109.371 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.639 ' HB3' ' HB3' ' A' ' 40' ' ' TYR . 47.2 m-85 -62.76 -37.72 87.74 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 107.638 -1.245 . . . . 0.35 107.638 175.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -55.45 -33.92 64.03 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.418 -1.265 . . . . 2.79 110.332 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.3 -35.08 28.34 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 115.983 -0.553 . . . . 0.88 110.617 -176.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.467 HG13 ' HB2' ' A' ' 40' ' ' TYR . 38.0 pt -90.44 16.14 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.404 -0.518 . . . . 0.6 111.042 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 28.74 73.91 Favored Glycine 0 C--O 1.238 0.39 0 CA-C-N 115.341 -0.845 . . . . 0.66 113.236 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.639 ' HB3' ' HB3' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -97.37 114.03 25.78 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 109.469 -0.567 . . . . 1.33 109.469 -177.694 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.11 149.98 25.17 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 116.053 -0.521 . . . . 1.06 110.547 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 77.6 p -50.74 -33.94 25.09 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.916 1.08 . . . . 1.03 113.916 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.31 -49.42 69.55 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.841 -0.8 . . . . 1.56 108.841 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.07 -37.91 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.723 -0.671 . . . . 0.43 109.838 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.662 HD21 HG23 ' A' ' 68' ' ' VAL . 63.5 tp -62.95 -46.39 87.97 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.393 -0.821 . . . . 0.43 110.994 177.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 67.6 mtt -63.05 -36.56 83.99 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 110.168 -0.308 . . . . 1.49 110.168 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 37.9 tt0 -64.55 -31.26 72.4 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.501 0.667 . . . . 1.88 110.831 176.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.52 HG21 HD13 ' A' ' 14' ' ' LEU . 96.8 m -66.06 -55.49 16.29 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.462 -1.31 . . . . 0.45 107.462 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.508 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.71 -38.63 72.59 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 113.909 -1.496 . . . . 0.27 109.795 175.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.8 78.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.486 0.714 . . . . 0.33 111.63 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 71.3 mtt180 -63.67 -39.38 94.2 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.365 -0.834 . . . . 2.84 109.933 179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 59.2 mt -65.36 -41.96 93.27 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.068 0.396 . . . . 0.9 112.068 176.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.8 mt-10 -57.59 -48.62 78.9 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 122.325 0.25 . . . . 0.48 110.544 175.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -63.43 -44.51 94.36 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.389 0.614 . . . . 1.19 111.428 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -65.99 -44.12 85.78 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.154 -0.93 . . . . 3.07 112.844 -176.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.441 ' HE1' ' HB3' ' A' ' 2' ' ' ALA . 80.0 m-85 -101.57 -18.59 15.85 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 115.296 1.591 . . . . 1.01 115.296 -177.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.84 62.37 1.77 Allowed Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.257 -0.973 . . . . 0.93 111.434 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.1 m -139.21 177.77 4.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 C-N-CA 123.523 0.729 . . . . 1.16 110.125 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -140.22 115.95 10.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 123.632 0.583 . . . . 1.87 109.855 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.508 HD12 ' HB1' ' A' ' 49' ' ' ALA . 86.4 mt -101.01 130.31 25.34 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.461 -0.79 . . . . 0.57 110.294 -177.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.93 126.75 22.02 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.781 2.321 . . . . 0.87 111.647 176.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -51.35 -54.01 30.64 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.854 1.262 . . . . 1.83 113.658 -173.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.11 -28.45 63.29 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 116.235 -0.439 . . . . 2.34 111.66 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.79 -37.62 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.462 -0.94 . . . . 0.66 108.462 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.93 -24.99 60.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.105 -0.952 . . . . 0.51 111.377 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.56 11.98 39.16 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 121.057 -0.592 . . . . 0.61 112.618 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -105.23 -21.62 13.22 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.378 0.608 . . . . 3.98 110.535 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.662 HG23 HD21 ' A' ' 45' ' ' LEU . 28.6 m -76.64 115.67 18.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 121.597 0.713 . . . . 0.44 111.286 -176.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.645 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 33.3 t70 -97.79 -23.76 15.75 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 121.62 0.724 . . . . 1.91 110.533 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.431 HG22 ' HD3' ' A' ' 34' ' ' ARG . 70.7 p -116.75 143.97 32.45 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.512 -0.767 . . . . 0.47 110.897 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.743 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 39.4 Cg_exo -59.36 -30.82 93.74 Favored 'Trans proline' 0 C--O 1.204 -1.204 0 C-N-CA 123.308 2.672 . . . . 0.32 112.352 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.553 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 6.0 ptp180 -54.75 -44.78 73.91 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.12 -0.232 . . . . 1.48 111.329 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.2 -46.19 81.71 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.197 0.522 . . . . 2.13 109.829 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.461 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.1 -45.13 82.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.263 -0.881 . . . . 0.9 110.553 -176.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.515 ' HB2' HD22 ' A' ' 10' ' ' LEU . 61.8 tp -57.2 -54.19 49.59 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 109.454 -0.573 . . . . 0.34 109.454 176.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -59.99 -37.73 80.54 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 123.908 0.755 . . . . 0.57 111.804 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.92 -50.1 74.78 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 122.925 0.49 . . . . 1.96 110.522 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.8 mt -70.41 -31.13 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.566 -0.531 . . . . 0.55 109.566 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -62.32 -39.61 93.62 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-N 116.067 -0.515 . . . . 1.14 109.647 174.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.58 -38.9 93.7 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.857 -0.497 . . . . 0.53 111.857 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.84 -37.89 79.44 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.23 0.538 . . . . 0.6 110.194 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.7 mt -74.93 -20.92 59.49 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.908 -0.587 . . . . 1.42 111.117 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.02 -27.15 67.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.027 0.441 . . . . 0.85 110.536 174.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -85.78 -22.39 27.71 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.434 0.635 . . . . 2.44 110.396 177.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.99 162.26 14.46 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.53 -0.759 . . . . 2.12 109.568 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.291 -1.961 0 N-CA-C 107.503 -1.295 . . . . 3.84 107.503 178.955 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 C--O 1.237 0.431 0 N-CA-C 110.071 -0.344 . . . . 6.63 110.071 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.28 114.13 14.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 121.295 0.569 . . . . 4.09 110.834 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 15.1 t -147.23 131.16 17.14 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 106.29 -1.744 . . . . 2.77 106.29 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.434 ' HA ' HD13 ' A' ' 82' ' ' LEU . 11.7 tp -68.46 149.46 49.27 Favored 'General case' 0 N--CA 1.411 -2.391 0 CA-C-N 115.083 -0.962 . . . . 1.51 111.398 -172.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.601 ' HG ' HD11 ' A' ' 82' ' ' LEU . 79.8 mt -98.5 129.07 45.08 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 115.091 -0.959 . . . . 0.8 108.42 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -96.6 -171.97 2.39 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 107.144 -1.428 . . . . 0.63 107.144 173.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 m -56.73 -38.91 73.03 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.265 0.555 . . . . 0.61 110.218 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.79 -41.1 60.63 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 111.367 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.94 -36.03 83.07 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.896 -0.779 . . . . 1.41 108.896 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.475 HD11 ' CD1' ' A' ' 74' ' ' LEU . 19.7 tp -66.21 -50.88 62.32 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.829 -1.078 . . . . 0.48 108.474 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.414 ' O ' HG23 ' A' ' 15' ' ' VAL . 11.9 ttp180 -50.33 -42.13 52.38 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.82 0.7 . . . . 2.46 111.509 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -53.21 -47.04 69.25 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.727 0.642 . . . . 3.93 110.325 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.569 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -66.06 -42.83 88.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.696 -0.684 . . . . 0.5 112.085 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.65 HD13 HG21 ' A' ' 48' ' ' THR . 4.1 mm? -64.08 -34.79 78.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.008 0.433 . . . . 1.44 111.157 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 11' ' ' ARG . 95.1 t -69.55 -25.03 27.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 120.997 0.427 . . . . 0.8 111.499 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 5.6 mm-40 -63.35 -45.96 88.76 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.174 0.511 . . . . 2.05 111.822 177.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 p -83.03 -20.97 34.01 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.443 0.64 . . . . 1.39 110.919 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.556 ' HB2' ' OH ' ' A' ' 40' ' ' TYR . . . -74.5 -18.57 60.59 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.689 -0.687 . . . . 1.58 111.437 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.55 -95.19 0.44 Allowed Glycine 0 C--O 1.222 -0.596 0 N-CA-C 111.125 -0.79 . . . . 2.32 111.125 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.97 25.88 0.65 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.448 0.642 . . . . 5.17 110.463 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.567 HG22 ' HA ' ' A' ' 25' ' ' ASP . 6.2 m 62.06 38.99 13.6 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.37 1.068 . . . . 4.86 109.792 -176.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -61.23 146.33 48.16 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 114.844 -1.071 . . . . 4.5 109.088 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.74 22.49 5.36 Favored Glycine 0 N--CA 1.416 -2.698 0 N-CA-C 109.417 -1.473 . . . . 2.77 109.417 -173.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.1 p 66.96 19.89 10.54 Favored 'General case' 0 C--O 1.247 0.947 0 C-N-CA 126.203 1.801 . . . . 2.87 112.722 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.567 ' HA ' HG22 ' A' ' 21' ' ' THR . 14.9 t70 61.29 130.38 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.379 1.071 . . . . 3.23 111.39 -172.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -110.97 24.91 12.35 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.784 -0.572 . . . . 1.16 111.813 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 t -61.29 113.51 2.66 Favored 'General case' 0 C--O 1.251 1.18 0 CA-C-O 121.037 0.446 . . . . 1.46 110.587 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.72 -140.89 15.59 Favored Glycine 0 N--CA 1.429 -1.795 0 N-CA-C 110.802 -0.919 . . . . 1.02 110.802 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -102.49 124.78 48.67 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.939 -0.763 . . . . 2.07 108.939 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -133.52 14.73 4.08 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.104 -0.638 . . . . 0.44 111.17 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.777 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 42.4 mt -52.86 -31.96 42.21 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 114.071 1.137 . . . . 0.39 114.071 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -94.29 -7.42 41.98 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 116.276 -0.42 . . . . 2.04 111.86 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mp -84.84 123.58 30.62 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.741 -1.207 . . . . 1.37 107.741 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -73.95 145.65 44.53 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 109.71 -0.478 . . . . 3.94 109.71 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.545 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 51.9 m-85 -61.49 -36.42 80.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.368 -0.605 . . . . 0.35 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -56.28 -36.78 68.99 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.318 -0.856 . . . . 2.79 110.726 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.9 -35.43 37.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.837 -0.62 . . . . 0.88 110.141 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -93.27 12.91 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 113.267 0.84 . . . . 0.6 113.267 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.49 41.11 30.91 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.051 -0.595 . . . . 0.66 114.27 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.556 ' OH ' ' HB2' ' A' ' 18' ' ' ALA . 13.7 m-85 -116.95 110.23 18.03 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 122.625 0.37 . . . . 1.33 110.724 176.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -88.46 155.09 19.86 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 120.562 -0.455 . . . . 1.06 110.313 174.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.416 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 79.4 p -51.94 -33.42 37.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.315 1.228 . . . . 1.03 114.315 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.26 -51.78 58.61 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.886 -0.413 . . . . 1.56 109.886 -178.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.49 89.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.498 0.666 . . . . 0.43 110.058 175.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.515 ' O ' ' HB ' ' A' ' 48' ' ' THR . 60.0 tp -62.37 -47.55 83.66 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.138 -0.937 . . . . 0.43 110.945 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 42' ' ' SER . 62.1 mtm -63.87 -37.23 86.61 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 122.443 -0.161 . . . . 1.49 110.796 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 40.2 tt0 -62.2 -31.43 71.95 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.49 0.662 . . . . 1.88 109.912 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.65 HG21 HD13 ' A' ' 14' ' ' LEU . 65.2 m -66.67 -56.9 8.49 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.591 -1.263 . . . . 0.45 107.591 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.506 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.34 -35.48 69.95 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 114.384 -1.28 . . . . 0.27 110.553 176.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.47 -44.05 84.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.411 0.684 . . . . 0.33 111.933 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.636 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 44.2 mtt180 -64.78 -37.12 86.54 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.303 -0.862 . . . . 2.84 109.412 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 13' ' ' ALA . 98.2 mt -67.62 -45.86 74.21 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.21 -0.905 . . . . 0.9 111.286 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.2 mt-10 -54.43 -51.99 63.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 123.093 0.557 . . . . 0.48 110.214 178.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 m -61.91 -48.85 78.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 114.943 -1.026 . . . . 1.19 111.829 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.46 HH11 ' HD3' ' A' ' 55' ' ' ARG . 12.0 ttm180 -65.6 -48.65 71.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.392 0.515 . . . . 3.07 112.392 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -91.86 2.57 56.44 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.215 0.82 . . . . 1.01 113.215 -171.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.71 56.5 18.74 Favored Glycine 0 C--O 1.25 1.102 0 CA-C-N 116.163 -0.471 . . . . 0.93 112.265 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.482 HG22 ' H ' ' A' ' 59' ' ' SER . 8.7 p -138.68 176.25 6.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 N-CA-C 107.962 -1.125 . . . . 1.16 107.962 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 58' ' ' VAL . 68.8 m -141.17 138.89 33.72 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 109.606 -0.516 . . . . 1.87 109.606 178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.506 HD12 ' HB1' ' A' ' 49' ' ' ALA . 65.6 mt -130.62 120.99 18.96 Favored Pre-proline 0 C--N 1.308 -1.223 0 N-CA-C 108.638 -0.875 . . . . 0.57 108.638 -177.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.416 ' HB2' HG23 ' A' ' 64' ' ' VAL . 38.1 Cg_exo -62.2 124.72 14.88 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.581 2.187 . . . . 0.87 110.175 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.408 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 5.4 p-10 -51.66 -31.53 25.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.713 1.205 . . . . 1.83 112.946 -177.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -69.02 -38.41 79.2 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.934 0.397 . . . . 2.34 110.546 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' A' ' 61' ' ' PRO . 21.3 t -75.59 -41.8 41.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.0 -1.111 . . . . 0.66 108.0 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -28.16 66.62 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 115.639 -0.71 . . . . 0.51 111.689 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.42 10.77 59.68 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 121.005 -0.617 . . . . 0.61 112.036 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -101.3 -24.39 14.23 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.837 -0.801 . . . . 3.98 108.837 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.568 HG21 HD23 ' A' ' 74' ' ' LEU . 30.3 m -79.14 97.55 2.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-O 122.245 1.022 . . . . 0.44 110.775 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -88.02 -21.01 25.03 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.273 -0.876 . . . . 1.91 111.221 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 p -121.39 142.87 36.31 Favored Pre-proline 0 N--CA 1.413 -2.319 0 CA-C-N 115.998 -0.546 . . . . 0.47 109.572 179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.777 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.7 Cg_exo -53.24 -34.9 71.8 Favored 'Trans proline' 0 CA--C 1.514 -0.478 0 C-N-CA 123.616 2.877 . . . . 0.32 113.34 -178.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -52.79 -44.22 66.43 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 123.475 0.485 . . . . 1.48 110.878 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB3' HG12 ' A' ' 68' ' ' VAL . 60.9 mm-40 -65.46 -47.96 74.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.262 0.625 . . . . 2.13 110.516 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.568 HD23 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -66.99 -42.93 84.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.323 -0.853 . . . . 0.9 110.333 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 51.1 tp -58.33 -50.2 74.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.636 -0.505 . . . . 0.34 109.636 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.42 -41.77 90.3 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.545 0.738 . . . . 0.57 111.094 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.97 -57.18 14.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.029 0.932 . . . . 1.96 108.738 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.3 mt -68.64 -31.85 52.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.51 0 CA-C-N 115.699 -0.682 . . . . 0.55 111.425 -176.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.77 -44.32 93.93 Favored 'General case' 0 N--CA 1.481 1.114 0 O-C-N 122.187 -0.32 . . . . 1.14 110.505 175.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.72 -39.58 90.21 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.378 -0.689 . . . . 0.53 111.378 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.62 -35.33 75.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.64 0.376 . . . . 0.6 111.455 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.601 HD11 ' HG ' ' A' ' 5' ' ' LEU . 55.6 mt -68.67 -31.96 71.46 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 122.927 0.491 . . . . 1.42 111.861 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.75 -19.13 64.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.217 0.532 . . . . 0.85 111.294 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -129.07 29.27 5.2 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.115 -0.493 . . . . 2.44 109.965 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.419 ' HB2' ' HA ' ' A' ' 82' ' ' LEU . . . -78.72 105.95 10.37 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.115 0.483 . . . . 2.12 110.025 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.754 0 N-CA-C 108.271 -1.011 . . . . 3.84 108.271 -179.477 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.9 mmm . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 110.31 -0.256 . . . . 6.63 110.31 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.458 ' HB1' HD22 ' A' ' 82' ' ' LEU . . . -78.62 126.17 30.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.03 0.443 . . . . 4.09 110.795 179.014 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.637 ' HB ' ' HE1' ' A' ' 56' ' ' TYR . 6.9 m -85.86 116.79 24.32 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.721 0.772 . . . . 2.77 108.944 178.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.3 tp -72.09 151.31 43.16 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 114.787 -1.097 . . . . 1.51 109.928 -176.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.474 HD21 ' CE2' ' A' ' 56' ' ' TYR . 87.5 mt -93.97 130.09 40.21 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.225 -0.898 . . . . 0.8 112.076 -174.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.0 p -99.01 -173.83 2.61 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 106.478 -1.675 . . . . 0.63 106.478 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.6 m -56.72 -46.72 81.14 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 118.589 0.631 . . . . 0.61 109.866 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.27 -39.83 93.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.596 0.591 . . . . 1.65 112.596 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.14 -39.97 93.76 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 109.034 -0.728 . . . . 1.41 109.034 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.441 HD11 HD12 ' A' ' 74' ' ' LEU . 19.7 tp -66.17 -51.93 53.03 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 114.927 -1.033 . . . . 0.48 108.294 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 15' ' ' VAL . 37.7 ttm180 -46.98 -47.37 21.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.251 1.42 . . . . 2.46 111.498 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.589 ' HD2' HH22 ' A' ' 55' ' ' ARG . 29.1 ttm180 -56.39 -48.92 75.91 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.857 0.723 . . . . 3.93 110.291 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.21 -37.98 89.4 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.836 -0.62 . . . . 0.5 111.095 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.432 HD13 HG21 ' A' ' 48' ' ' THR . 4.4 mm? -62.93 -45.12 93.97 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.054 -0.351 . . . . 1.44 110.054 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.534 HG22 ' HA3' ' A' ' 23' ' ' GLY . 85.5 t -60.0 -52.39 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 109.73 -0.47 . . . . 0.8 109.73 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.409 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.0 mt-10 -57.55 -41.82 81.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.16 -0.473 . . . . 2.05 111.677 -178.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.541 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.0 m -77.26 -32.76 55.87 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 112.038 0.385 . . . . 1.39 112.038 -177.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.45 -19.65 52.69 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.344 0.592 . . . . 1.58 110.506 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.71 119.77 2.21 Favored Glycine 0 N--CA 1.428 -1.866 0 N-CA-C 110.03 -1.228 . . . . 2.32 110.03 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -5.46 1.86 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.357 1.614 . . . . 5.17 115.357 -176.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 t -70.83 -54.23 12.34 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.218 -0.446 . . . . 4.86 110.189 175.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.62 126.5 16.24 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.673 -0.862 . . . . 4.5 108.673 -175.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.534 ' HA3' HG22 ' A' ' 15' ' ' VAL . . . -91.99 51.33 2.85 Favored Glycine 0 CA--C 1.477 -2.309 0 C-N-CA 120.777 -0.725 . . . . 2.77 113.126 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.477 ' HB ' ' CD2' ' A' ' 26' ' ' LEU . 7.8 m 44.91 -116.74 0.55 Allowed 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 124.605 1.162 . . . . 2.87 112.388 172.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -122.36 28.75 7.27 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 123.494 0.718 . . . . 3.23 110.521 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.477 ' CD2' ' HB ' ' A' ' 24' ' ' THR . 2.4 mm? -87.45 2.6 50.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.511 0.93 . . . . 1.16 113.511 -175.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -72.84 130.07 39.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.15 -1.055 . . . . 1.46 108.15 177.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 93.39 -168.58 29.66 Favored Glycine 0 N--CA 1.43 -1.757 0 N-CA-C 109.299 -1.52 . . . . 1.02 109.299 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -92.73 142.35 27.46 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 107.547 -1.279 . . . . 2.07 107.547 178.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.448 ' HA ' HD13 ' A' ' 33' ' ' LEU . 30.9 p90 -135.12 15.55 3.51 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.284 -0.566 . . . . 0.44 111.863 -174.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 65.0 mt -52.87 -24.86 9.97 Favored 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 116.115 1.895 . . . . 0.39 116.115 -175.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -95.21 -12.25 26.63 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.057 0.39 . . . . 2.04 111.798 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.448 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.3 mp -81.17 119.77 24.01 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.421 -0.585 . . . . 1.37 109.421 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 141.55 41.63 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.298 -1.001 . . . . 3.94 108.298 -178.194 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.5 m-85 -58.6 -37.95 76.95 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.47 0.481 . . . . 0.35 111.409 -176.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.49 -33.81 64.03 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.37 0.668 . . . . 2.79 111.364 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -82.62 -31.74 28.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.88 110.74 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.416 HG13 ' HD1' ' A' ' 40' ' ' TYR . 24.0 pt -93.16 22.52 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 N-CA-C 112.436 0.532 . . . . 0.6 112.436 -177.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.69 35.4 55.15 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.878 -0.601 . . . . 0.66 113.961 173.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 14.4 m-85 -108.24 116.9 32.82 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 112.582 0.586 . . . . 1.33 112.582 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -82.68 147.01 28.75 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 106.687 -1.597 . . . . 1.06 106.687 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 p -53.3 -35.93 60.65 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.754 1.02 . . . . 1.03 113.754 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.41 -46.93 71.75 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 109.273 -0.64 . . . . 1.56 109.273 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -61.45 -33.59 74.0 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.524 0.678 . . . . 0.43 110.33 176.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.414 ' O ' ' HB ' ' A' ' 48' ' ' THR . 51.4 tp -63.75 -51.27 65.65 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.436 -0.802 . . . . 0.43 109.95 175.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.5 mtm -63.79 -30.84 71.89 Favored 'General case' 0 C--O 1.206 -1.224 0 CA-C-N 116.36 -0.382 . . . . 1.49 111.227 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.446 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 8.5 tp10 -60.96 -37.89 83.98 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.551 1.14 . . . . 1.88 109.325 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.541 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 71.7 m -67.19 -56.7 8.83 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 113.998 -1.455 . . . . 0.45 107.953 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.525 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -56.69 -34.99 67.94 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.39 -1.277 . . . . 0.27 110.419 176.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.451 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -59.16 -41.93 89.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.303 0.641 . . . . 0.33 111.549 179.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.2 mtt180 -64.86 -42.0 95.23 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.792 -0.64 . . . . 2.84 109.33 176.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 49' ' ' ALA . 91.6 mt -61.71 -41.66 97.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.239 -0.437 . . . . 0.9 110.456 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.0 mt-10 -57.13 -56.38 22.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.878 -0.601 . . . . 0.48 110.139 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 t -62.77 -50.68 70.07 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.032 -0.986 . . . . 1.19 111.374 -177.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.589 HH22 ' HD2' ' A' ' 12' ' ' ARG . 65.4 ttt180 -63.26 -44.28 95.6 Favored 'General case' 0 C--N 1.313 -0.993 0 C-N-CA 125.05 1.34 . . . . 3.07 113.301 -175.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.637 ' HE1' ' HB ' ' A' ' 3' ' ' THR . 92.4 m-85 -97.07 -12.53 23.07 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.612 -0.835 . . . . 1.01 113.178 -176.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 56.65 2.95 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.109 -1.043 . . . . 0.93 110.594 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.473 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 12.6 p -139.51 176.3 6.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.676 -1.231 . . . . 1.16 107.676 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 58' ' ' VAL . 8.1 t -141.96 136.23 30.15 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.973 -1.121 . . . . 1.87 107.973 177.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.429 HD12 ' HB1' ' A' ' 49' ' ' ALA . 69.2 mt -124.14 126.57 25.55 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.328 -0.249 . . . . 0.57 110.328 -175.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.2 131.45 41.3 Favored 'Trans proline' 0 C--O 1.247 0.96 0 C-N-CA 122.836 2.357 . . . . 0.87 111.573 175.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.26 -40.65 64.78 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.935 1.294 . . . . 1.83 112.496 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 14.9 t70 -66.31 -40.89 90.27 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.111 -0.495 . . . . 2.34 111.002 -178.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.2 t -72.63 -40.04 61.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 109.229 -0.656 . . . . 0.66 109.229 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.3 65.82 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.528 -0.76 . . . . 0.51 111.696 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.44 11.47 39.45 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.629 -0.796 . . . . 0.61 112.506 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 11.3 tpt180 -97.14 -20.0 18.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.698 0.761 . . . . 3.98 109.841 -177.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.521 HG21 HD23 ' A' ' 74' ' ' LEU . 24.3 m -79.2 117.11 24.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-N 115.093 -0.958 . . . . 0.44 112.229 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -94.4 -39.05 10.66 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 115.506 -0.77 . . . . 1.91 110.677 175.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 47.0 p -104.65 136.91 19.11 Favored Pre-proline 0 N--CA 1.407 -2.589 0 CA-C-N 115.723 -0.671 . . . . 0.47 111.112 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.59 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.8 Cg_exo -52.17 -35.69 63.86 Favored 'Trans proline' 0 CA--C 1.516 -0.411 0 C-N-CA 124.079 3.186 . . . . 0.32 113.787 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -53.42 -42.66 67.26 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.851 0.315 . . . . 1.48 111.851 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -65.14 -46.01 82.68 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.184 0.594 . . . . 2.13 110.55 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.521 HD23 HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -65.84 -48.74 70.6 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.11 -0.95 . . . . 0.9 109.411 -178.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.01 -54.59 45.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.34 110.922 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.12 -40.61 98.11 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 112.626 0.602 . . . . 0.57 112.626 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.23 -48.65 80.5 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 108.86 -0.793 . . . . 1.96 108.86 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 65.9 mt -67.16 -35.16 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 116.074 -0.512 . . . . 0.55 110.702 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -57.41 -43.45 83.77 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 110.124 -0.324 . . . . 1.14 110.124 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.48 -40.22 97.52 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.825 -0.625 . . . . 0.53 111.919 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.5 -41.99 71.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.104 0.478 . . . . 0.6 111.032 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.458 HD22 ' HB1' ' A' ' 2' ' ' ALA . 62.5 mt -66.32 -31.43 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 1.42 111.855 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.84 -24.5 65.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.966 0.412 . . . . 0.85 111.688 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -81.09 -3.16 51.06 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.075 0.398 . . . . 2.44 112.075 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -130.42 9.42 5.13 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.904 0.859 . . . . 2.12 110.04 178.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.189 0 CA-C-N 115.643 -0.708 . . . . 3.84 109.106 -179.313 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 C--O 1.245 0.836 0 N-CA-C 109.471 -0.566 . . . . 6.63 109.471 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.84 76.44 0.33 Allowed 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 123.685 0.794 . . . . 4.09 110.469 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 9.0 t -105.27 122.08 45.2 Favored 'General case' 0 N--CA 1.42 -1.964 0 CA-C-N 115.693 -0.685 . . . . 2.77 109.672 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.77 125.85 25.69 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.459 -0.791 . . . . 1.51 109.813 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.528 ' H ' HD22 ' A' ' 5' ' ' LEU . 1.4 mm? -71.62 139.41 49.3 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.763 -1.108 . . . . 0.8 109.732 -176.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.7 p -97.64 -170.69 2.04 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 105.181 -2.155 . . . . 0.63 105.181 167.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.836 HG21 ' HA ' ' A' ' 29' ' ' ASP . 41.8 m -56.92 -47.54 80.37 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 119.244 0.929 . . . . 0.61 110.123 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.8 -48.36 79.94 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.977 -0.556 . . . . 1.65 112.387 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HB3' HD12 ' A' ' 5' ' ' LEU . 16.2 m-20 -66.15 -38.6 88.5 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.134 -0.484 . . . . 1.41 110.484 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.426 HD22 HD13 ' A' ' 75' ' ' LEU . 16.5 tp -66.95 -46.8 73.58 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 108.4 -0.963 . . . . 0.48 108.4 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' O ' HG23 ' A' ' 15' ' ' VAL . 41.1 ttp180 -53.54 -46.48 70.2 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 123.792 0.837 . . . . 2.46 110.858 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.5 ttt180 -54.33 -50.55 67.13 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.391 0.432 . . . . 3.93 110.251 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.42 -40.65 95.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.752 -0.658 . . . . 0.5 111.351 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.412 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 10.2 mp -64.21 -44.03 93.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.875 -0.33 . . . . 1.44 111.786 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 11' ' ' ARG . 96.9 t -60.93 -45.42 98.38 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 N-CA-C 109.928 -0.397 . . . . 0.8 109.928 178.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 42.3 mt-10 -60.58 -47.52 85.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 2.05 110.955 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.539 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 38.9 m -65.38 -38.64 90.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.642 -0.708 . . . . 1.39 112.484 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.85 -46.36 78.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.383 -0.599 . . . . 1.58 109.383 178.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.15 -17.33 58.52 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 115.423 -0.808 . . . . 2.32 112.581 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -76.43 173.76 11.09 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 122.721 0.408 . . . . 5.17 111.653 -178.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -69.3 -92.78 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.842 -0.617 . . . . 4.86 112.294 -174.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -91.52 146.23 23.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.667 -0.864 . . . . 4.5 108.667 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.47 79.16 0.57 Allowed Glycine 0 N--CA 1.418 -2.517 0 CA-C-O 119.063 -0.854 . . . . 2.77 111.642 -177.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.8 p 37.19 -116.1 0.13 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.228 1.411 . . . . 2.87 113.122 174.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -118.94 17.46 13.36 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 106.567 -1.642 . . . . 3.23 106.567 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.498 ' CD1' HD12 ' A' ' 38' ' ' ILE . 16.4 tp -66.47 -27.13 67.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.54 -1.664 . . . . 1.16 109.412 -179.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.0 t -76.88 97.67 4.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.164 0.983 . . . . 1.46 110.887 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.24 -166.6 39.82 Favored Glycine 0 N--CA 1.428 -1.869 0 N-CA-C 106.521 -2.632 . . . . 1.02 106.521 177.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.836 ' HA ' HG21 ' A' ' 7' ' ' THR . 11.5 t70 -85.66 97.8 10.32 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.101 -1.815 . . . . 2.07 106.101 173.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -110.46 25.57 11.64 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.706 -0.679 . . . . 0.44 112.35 -169.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.78 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 50.6 mt -50.36 -27.75 6.84 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.061 1.874 . . . . 0.39 116.061 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -97.58 -5.19 36.18 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 118.43 0.559 . . . . 2.04 112.061 -177.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.431 HD23 HG21 ' A' ' 38' ' ' ILE . 9.4 mp -77.18 125.14 28.84 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.525 -0.734 . . . . 1.37 111.115 -177.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.442 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 10.4 mpt_? -73.74 129.62 38.29 Favored 'General case' 0 C--O 1.247 0.951 0 N-CA-C 108.438 -0.949 . . . . 3.94 108.438 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.473 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 80.6 m-85 -55.05 -50.37 69.27 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.296 0.997 . . . . 0.35 113.399 -173.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -53.51 -27.04 23.43 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 113.179 0.807 . . . . 2.79 113.179 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.78 -33.05 27.44 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.371 0.605 . . . . 0.88 110.187 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.498 HD12 ' CD1' ' A' ' 26' ' ' LEU . 12.6 pt -96.75 22.81 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 112.958 0.725 . . . . 0.6 112.958 -175.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.17 21.77 54.02 Favored Glycine 0 CA--C 1.506 -0.483 0 CA-C-N 115.799 -0.637 . . . . 0.66 113.997 174.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.473 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 26.6 m-85 -123.06 102.6 8.08 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 112.023 0.379 . . . . 1.33 112.023 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -82.34 147.22 28.96 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 106.914 -1.513 . . . . 1.06 106.914 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.581 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 23.8 m -50.01 -22.44 1.59 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.839 1.051 . . . . 1.03 113.839 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.57 -58.76 5.46 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.764 -0.585 . . . . 1.56 110.006 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -62.68 -26.83 68.86 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.645 0.736 . . . . 0.43 109.86 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.581 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 28.8 tp -64.28 -47.23 80.32 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 115.393 -0.821 . . . . 0.43 110.251 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.579 ' HG3' ' O ' ' A' ' 42' ' ' SER . 56.0 mtm -63.58 -33.12 74.89 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 110.051 -0.352 . . . . 1.49 110.051 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.496 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 10.9 tp10 -60.55 -37.82 82.48 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 121.957 0.884 . . . . 1.88 109.349 176.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.468 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 79.4 m -70.14 -55.98 8.03 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.319 -1.309 . . . . 0.45 107.866 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.652 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -54.9 -36.03 64.76 Favored 'General case' 0 C--O 1.203 -1.356 0 CA-C-N 114.0 -1.455 . . . . 0.27 110.809 178.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.52 83.62 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-O 121.538 0.685 . . . . 0.33 112.015 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.539 ' CZ ' ' HA ' ' A' ' 17' ' ' SER . 77.6 mtt180 -68.9 -37.83 79.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.279 -0.873 . . . . 2.84 109.599 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.652 HD12 ' HA ' ' A' ' 49' ' ' ALA . 56.8 mt -62.75 -46.32 88.6 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.903 -1.044 . . . . 0.9 109.557 176.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -55.98 -58.06 9.49 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.606 -0.725 . . . . 0.48 111.218 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.0 t -63.13 -56.37 17.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.38 -0.827 . . . . 1.19 112.284 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.548 ' HD2' ' CZ ' ' A' ' 56' ' ' TYR . 35.5 ttm180 -65.02 -43.82 91.18 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.769 0.655 . . . . 3.07 112.769 -173.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.548 ' CZ ' ' HD2' ' A' ' 55' ' ' ARG . 61.7 m-85 -98.04 -3.26 38.45 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.175 -0.61 . . . . 1.01 112.514 -173.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.62 43.42 43.87 Favored Glycine 0 C--N 1.318 -0.425 0 C-N-CA 120.645 -0.788 . . . . 0.93 112.822 176.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.416 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 11.4 p -114.91 143.15 25.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 N-CA-C 109.421 -0.585 . . . . 1.16 109.421 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 m -99.74 120.35 39.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 109.126 -0.694 . . . . 1.87 109.126 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.1 mt -126.56 107.39 23.4 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 109.434 -0.58 . . . . 0.57 109.434 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.68 141.75 97.92 Favored 'Trans proline' 0 C--O 1.242 0.691 0 C-N-CA 122.324 2.016 . . . . 0.87 110.97 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -52.2 -39.84 60.72 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.432 1.093 . . . . 1.83 112.465 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.687 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 32.8 t70 -69.01 -38.81 79.45 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.58 -0.282 . . . . 2.34 110.88 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.6 t -69.97 -38.29 74.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.897 -0.779 . . . . 0.66 108.897 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -21.42 59.03 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.58 -0.736 . . . . 0.51 111.819 176.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.3 7.74 28.69 Favored Glycine 0 N--CA 1.442 -0.941 0 C-N-CA 121.162 -0.542 . . . . 0.61 112.219 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 24.3 mmm180 -101.31 -15.55 17.22 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.541 0.686 . . . . 3.98 109.958 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.579 HG23 HD21 ' A' ' 45' ' ' LEU . 30.9 m -78.07 101.39 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-O 122.456 1.122 . . . . 0.44 109.42 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.461 ' OD2' HG23 ' A' ' 70' ' ' THR . 8.5 t70 -88.2 -25.76 22.74 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.041 -1.436 . . . . 1.91 111.262 -177.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.461 HG23 ' OD2' ' A' ' 69' ' ' ASP . 30.1 p -133.62 147.39 64.39 Favored Pre-proline 0 N--CA 1.422 -1.838 0 CA-C-N 115.432 -0.804 . . . . 0.47 108.944 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.78 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 57.1 Cg_exo -55.7 -35.77 93.8 Favored 'Trans proline' 0 C--O 1.208 -0.98 0 C-N-CA 123.302 2.668 . . . . 0.32 112.037 177.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.579 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 9.8 ptm180 -54.33 -39.8 67.4 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 123.209 0.318 . . . . 1.48 111.615 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -67.33 -48.78 66.52 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 121.544 0.688 . . . . 2.13 110.693 174.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.529 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.35 -48.19 71.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.636 -1.165 . . . . 0.9 111.682 -174.022 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' ' 5' ' ' LEU . 31.3 tp -57.02 -47.53 80.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 123.027 0.531 . . . . 0.34 109.709 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.21 -43.18 96.17 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.055 -0.975 . . . . 0.57 111.303 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.42 -48.82 79.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.793 -0.639 . . . . 1.96 109.536 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.418 ' CD1' HD13 ' A' ' 52' ' ' LEU . 49.1 mt -65.76 -43.08 93.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 N-CA-C 110.359 -0.237 . . . . 0.55 110.359 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.06 -43.01 91.67 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 120.785 -0.366 . . . . 1.14 110.445 177.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.7 -40.05 93.83 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 116.056 -0.52 . . . . 0.53 112.301 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.18 71.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.076 0.465 . . . . 0.6 110.518 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.9 mt -70.3 -16.53 63.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.083 -0.508 . . . . 1.42 112.001 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.99 66.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.865 0.364 . . . . 0.85 110.688 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -86.58 -11.48 51.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.428 -0.351 . . . . 2.44 111.111 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.62 79.09 5.05 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.941 0.877 . . . . 2.12 110.294 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.947 0 N-CA-C 106.391 -1.707 . . . . 3.84 106.391 179.966 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.7 mtp . . . . . 0 CA--C 1.501 -0.906 0 N-CA-C 108.836 -0.802 . . . . 6.63 108.836 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.38 97.68 6.02 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 120.326 -0.55 . . . . 4.09 110.395 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.618 ' HB ' ' HE1' ' A' ' 56' ' ' TYR . 21.6 m -77.87 106.63 9.84 Favored 'General case' 0 CA--C 1.491 -1.326 0 N-CA-C 106.681 -1.6 . . . . 2.77 106.681 174.219 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.8 tp -86.39 157.66 19.8 Favored 'General case' 0 N--CA 1.389 -3.491 0 CA-C-N 113.641 -1.618 . . . . 1.51 109.393 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.445 ' O ' HD11 ' A' ' 75' ' ' LEU . 84.8 mt -106.74 126.36 52.2 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 108.901 -0.777 . . . . 0.8 108.901 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -93.42 -173.35 3.19 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.074 -1.454 . . . . 0.63 107.074 171.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.937 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.0 m -56.96 -47.14 81.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.087 -0.709 . . . . 0.61 109.087 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -58.74 -47.34 84.94 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.226 -0.897 . . . . 1.65 112.055 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -66.29 -32.29 73.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 120.652 -0.419 . . . . 1.41 110.489 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.411 HD11 ' CD1' ' A' ' 74' ' ' LEU . 17.8 tp -68.09 -46.73 70.18 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.807 -0.812 . . . . 0.48 108.807 178.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.579 ' O ' HG23 ' A' ' 15' ' ' VAL . 47.3 ttp180 -51.57 -48.39 63.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.791 -0.64 . . . . 2.46 110.574 176.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.491 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.7 ttm105 -53.39 -43.4 67.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 115.479 -0.782 . . . . 3.93 111.54 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.404 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -62.78 -40.76 98.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.032 0.444 . . . . 0.5 110.614 -179.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.46 HD12 HG21 ' A' ' 48' ' ' THR . 10.2 mp -65.95 -37.43 86.01 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.939 -0.573 . . . . 1.44 110.893 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 11' ' ' ARG . 16.5 t -71.47 -36.6 61.24 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 121.462 0.648 . . . . 0.8 109.398 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 60.3 mm-40 -64.04 -34.17 77.4 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.65 -0.657 . . . . 2.05 111.065 176.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.1 t -84.02 -52.43 6.32 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 116.309 -0.405 . . . . 1.39 111.498 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.5 0.72 24.89 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 113.087 0.773 . . . . 1.58 113.087 -173.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.47 -147.62 42.5 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 110.407 -1.077 . . . . 2.32 110.407 -177.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.92 13.63 33.22 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 121.463 0.649 . . . . 5.17 109.496 175.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 m -70.8 -71.13 0.26 Allowed 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.977 -1.49 . . . . 4.86 106.977 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -86.52 108.0 18.35 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.194 -1.41 . . . . 4.5 107.194 172.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.62 60.89 0.03 OUTLIER Glycine 0 CA--C 1.462 -3.268 0 N-CA-C 109.158 -1.577 . . . . 2.77 109.158 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -93.81 83.13 4.35 Favored 'General case' 0 N--CA 1.394 -3.235 0 CA-C-N 113.921 -1.139 . . . . 2.87 110.48 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 74.42 60.11 0.08 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.761 1.224 . . . . 3.23 111.935 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.416 ' HG ' ' CD2' ' A' ' 30' ' ' PHE . 9.6 mp -100.09 -5.11 28.43 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.958 -1.019 . . . . 1.16 110.657 178.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m -71.21 139.19 50.04 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.531 -0.758 . . . . 1.46 109.749 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.48 -117.43 4.84 Favored Glycine 0 CA--C 1.499 -0.934 0 N-CA-C 109.923 -1.271 . . . . 1.02 109.923 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.937 ' HA ' HG21 ' A' ' 7' ' ' THR . 17.4 m-20 -126.33 113.14 16.53 Favored 'General case' 0 CA--C 1.487 -1.452 0 CA-C-N 117.403 0.601 . . . . 2.07 109.821 177.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.416 ' CD2' ' HG ' ' A' ' 26' ' ' LEU . 18.1 p90 -112.88 9.91 18.96 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.547 -0.751 . . . . 0.44 109.98 179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.818 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 59.0 mt -52.93 -24.85 10.15 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.86 1.43 . . . . 0.39 114.86 -177.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -93.25 -19.94 20.91 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 120.819 0.342 . . . . 2.04 110.547 -176.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.5 mp -77.89 125.0 28.69 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 109.347 -0.612 . . . . 1.37 109.347 -176.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -74.85 135.61 41.58 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.743 -0.836 . . . . 3.94 108.743 -177.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -56.85 -46.65 81.6 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.354 0.409 . . . . 0.35 109.914 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -55.08 -28.54 53.18 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.156 0.982 . . . . 2.79 111.247 178.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -85.59 -32.83 21.88 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.812 -0.631 . . . . 0.88 111.873 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -96.26 30.4 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 113.836 1.051 . . . . 0.6 113.836 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.96 -16.78 60.6 Favored Glycine 0 C--N 1.316 -0.531 0 C-N-CA 120.587 -0.816 . . . . 0.66 113.521 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.439 ' CZ ' HD23 ' A' ' 14' ' ' LEU . 35.5 m-85 -81.61 163.93 22.22 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.718 0.771 . . . . 1.33 111.578 -177.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -135.46 140.84 45.17 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.088 -1.819 . . . . 1.06 106.088 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.486 ' O ' ' HG3' ' A' ' 46' ' ' MET . 57.6 p -48.45 -32.57 7.96 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 124.562 1.145 . . . . 1.03 113.641 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HA ' ' HE2' ' A' ' 46' ' ' MET . 6.1 tt -64.98 -50.63 65.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.482 -0.562 . . . . 1.56 109.482 177.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 -36.15 81.61 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.41 0.624 . . . . 0.43 110.293 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.545 HD21 HG23 ' A' ' 68' ' ' VAL . 61.0 tp -61.25 -37.15 82.05 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.83 -1.077 . . . . 0.43 110.54 179.084 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.0 mtm -63.1 -33.1 74.72 Favored 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 111.884 0.327 . . . . 1.49 111.884 178.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.66 -37.42 87.52 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.09 0.948 . . . . 1.88 109.468 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.46 HG21 HD12 ' A' ' 14' ' ' LEU . 31.2 m -66.94 -54.6 20.41 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.295 -1.321 . . . . 0.45 108.073 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.496 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.63 -34.81 69.71 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 114.916 -1.038 . . . . 0.27 110.044 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.94 -41.9 88.48 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 123.237 0.615 . . . . 0.33 111.322 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 mtp180 -64.93 -40.71 95.46 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 115.34 -0.845 . . . . 2.84 110.024 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.404 HD21 ' HB2' ' A' ' 13' ' ' ALA . 97.3 mt -63.96 -41.14 97.65 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.974 -0.557 . . . . 0.9 110.922 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.5 mt-10 -56.58 -55.0 39.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 123.686 0.616 . . . . 0.48 109.58 174.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -63.87 -42.44 97.51 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.097 -0.956 . . . . 1.19 111.757 -177.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -65.15 -51.91 58.35 Favored 'General case' 0 C--O 1.215 -0.725 0 C-N-CA 123.034 0.534 . . . . 3.07 111.636 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.618 ' HE1' ' HB ' ' A' ' 3' ' ' THR . 92.3 m-85 -93.68 -7.74 42.9 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 113.52 0.933 . . . . 1.01 113.52 -171.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.92 53.95 4.71 Favored Glycine 0 C--N 1.312 -0.793 0 C-N-CA 120.458 -0.877 . . . . 0.93 111.357 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.451 HG22 ' H ' ' A' ' 59' ' ' SER . 9.9 p -139.5 176.33 6.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.001 -1.111 . . . . 1.16 108.001 -177.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.451 ' H ' HG22 ' A' ' 58' ' ' VAL . 12.1 p -141.81 140.92 33.11 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 118.624 0.647 . . . . 1.87 110.422 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.496 HD12 ' HB1' ' A' ' 49' ' ' ALA . 61.2 mt -126.25 123.32 24.25 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.096 -1.076 . . . . 0.57 108.096 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.57 128.07 25.87 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.361 2.041 . . . . 0.87 110.1 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.66 -27.86 29.9 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.962 0.905 . . . . 1.83 113.355 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -67.2 -44.71 78.94 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.495 -0.557 . . . . 2.34 109.495 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.89 -41.94 60.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.852 -0.796 . . . . 0.66 108.852 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.98 -27.82 63.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.68 -0.691 . . . . 0.51 111.854 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.35 -1.51 47.49 Favored Glycine 0 N--CA 1.44 -1.087 0 C-N-CA 120.437 -0.887 . . . . 0.61 112.052 177.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -99.57 -10.55 21.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.295 0.569 . . . . 3.98 110.549 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.545 HG23 HD21 ' A' ' 45' ' ' LEU . 13.2 m -79.32 103.82 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.805 0 CA-C-O 121.582 0.706 . . . . 0.44 110.041 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.93 -40.36 14.88 Favored 'General case' 0 CA--C 1.482 -1.67 0 CA-C-N 115.523 -0.762 . . . . 1.91 110.862 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.1 p -107.86 133.03 20.62 Favored Pre-proline 0 N--CA 1.402 -2.865 0 CA-C-N 115.261 -0.881 . . . . 0.47 110.153 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.818 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.7 Cg_exo -50.71 -31.75 33.71 Favored 'Trans proline' 0 C--O 1.213 -0.755 0 C-N-CA 123.867 3.045 . . . . 0.32 113.285 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 11.5 ptp85 -52.94 -48.1 67.57 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 120.923 0.392 . . . . 1.48 110.781 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.412 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 10.5 mm-40 -66.15 -41.45 90.38 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 123.88 0.872 . . . . 2.13 110.651 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.544 HD23 HG21 ' A' ' 68' ' ' VAL . 3.0 tm? -68.26 -45.55 72.85 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.092 -0.958 . . . . 0.9 109.454 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 5' ' ' LEU . 32.3 tp -57.16 -51.9 67.45 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.724 -0.671 . . . . 0.34 109.392 178.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -56.65 -45.0 81.86 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.044 0.938 . . . . 0.57 112.1 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.39 -49.33 77.32 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.296 -0.631 . . . . 1.96 109.296 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.455 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 61.6 mt -66.88 -45.21 88.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 116.168 -0.469 . . . . 0.55 110.396 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -45.95 71.77 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.563 0.345 . . . . 1.14 110.671 177.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.6 -42.56 97.31 Favored Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.887 -0.597 . . . . 0.53 112.377 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.62 -38.28 80.42 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.323 0.249 . . . . 0.6 110.818 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 80.3 mt -60.79 -46.18 91.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.385 0.612 . . . . 1.42 110.28 177.47 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.38 65.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.672 -0.695 . . . . 0.85 111.548 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -98.59 7.21 46.4 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-O 121.848 0.832 . . . . 2.44 110.756 -177.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -94.56 18.49 11.32 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.732 -0.605 . . . . 2.12 110.463 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 C-N-CA 125.119 1.368 . . . . 3.84 110.01 -177.083 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.506 -0.719 0 N-CA-C 108.673 -0.862 . . . . 6.63 108.673 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.604 ' HB1' ' HG ' ' A' ' 82' ' ' LEU . . . -140.19 104.56 4.84 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 121.209 0.528 . . . . 4.09 111.287 -178.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 80.7 m -93.55 118.7 31.69 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 107.998 -1.112 . . . . 2.77 107.998 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 tp -56.63 149.36 17.82 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 113.857 -1.519 . . . . 1.51 112.075 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.08 127.07 35.99 Favored 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 114.865 -1.061 . . . . 0.8 109.827 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -101.2 179.82 4.26 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 107.07 -1.455 . . . . 0.63 107.07 170.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.885 HG21 ' HA ' ' A' ' 29' ' ' ASP . 19.4 m -58.29 -40.88 83.14 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.413 0.625 . . . . 0.61 109.594 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.39 -53.7 55.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 114.747 -1.115 . . . . 1.65 111.237 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 12' ' ' ARG . 8.5 t70 -69.6 -33.23 72.39 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 121.293 0.568 . . . . 1.41 110.395 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.493 HD11 HD12 ' A' ' 74' ' ' LEU . 17.8 tp -65.32 -45.89 82.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.158 -0.682 . . . . 0.48 109.158 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 15' ' ' VAL . 45.4 ttp180 -54.25 -43.91 71.34 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 123.937 0.895 . . . . 2.46 109.978 176.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 53.6 ttt180 -54.84 -45.82 74.54 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 115.163 -0.926 . . . . 3.93 110.726 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.478 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -61.05 -40.65 94.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.094 -0.503 . . . . 0.5 111.148 -178.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -64.78 -44.2 90.74 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 121.105 -0.238 . . . . 1.44 111.201 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 11' ' ' ARG . 60.6 t -63.19 -47.95 89.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.284 -0.416 . . . . 0.8 110.019 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.04 -32.17 73.47 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.832 0.308 . . . . 2.05 111.832 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.497 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 35.7 t -74.45 -52.96 10.52 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.773 0.321 . . . . 1.39 111.395 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.78 -44.45 61.55 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.308 -0.405 . . . . 1.58 111.614 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.38 -125.55 8.16 Favored Glycine 0 N--CA 1.429 -1.773 0 N-CA-C 109.577 -1.409 . . . . 2.32 109.577 -177.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -84.77 102.77 13.29 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.306 0.574 . . . . 5.17 111.155 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.2 t -139.28 -156.19 0.66 Allowed 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.042 -1.466 . . . . 4.86 107.042 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -122.3 123.43 41.41 Favored 'General case' 0 C--N 1.293 -1.86 0 N-CA-C 109.391 -0.596 . . . . 4.5 109.391 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.28 63.89 4.27 Favored Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 110.907 -0.877 . . . . 2.77 110.907 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.462 HG23 HG22 ' A' ' 38' ' ' ILE . 9.2 t -59.89 92.91 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.416 1.086 . . . . 2.87 111.467 -177.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 64.61 24.95 13.08 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 114.404 -1.271 . . . . 3.23 110.405 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.2 tp -76.75 -33.66 58.1 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.874 -1.057 . . . . 1.16 109.581 -176.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.0 m -61.05 133.91 56.54 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.063 -0.971 . . . . 1.46 110.436 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.36 -136.86 14.01 Favored Glycine 0 N--CA 1.433 -1.528 0 N-CA-C 110.457 -1.057 . . . . 1.02 110.457 -176.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.885 ' HA ' HG21 ' A' ' 7' ' ' THR . 4.2 m-20 -100.1 98.84 9.51 Favored 'General case' 0 CA--C 1.49 -1.359 0 CA-C-O 121.319 0.581 . . . . 2.07 110.638 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.447 ' HA ' HD23 ' A' ' 33' ' ' LEU . 21.7 p90 -95.35 13.26 26.31 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.391 -0.822 . . . . 0.44 110.144 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.725 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 58.6 mt -50.82 -23.95 3.14 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.82 1.785 . . . . 0.39 115.82 -175.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.98 -8.93 32.39 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.39 0.614 . . . . 2.04 111.414 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 30' ' ' PHE . 3.9 mm? -79.12 123.72 27.63 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.612 -0.514 . . . . 1.37 109.612 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -75.48 141.52 43.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.175 -1.046 . . . . 3.94 108.175 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.6 m-85 -59.99 -41.38 91.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 110.278 -0.268 . . . . 0.35 110.278 -178.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -57.76 -27.37 62.99 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.355 0.597 . . . . 2.79 111.344 176.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -84.79 -33.96 22.88 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.094 0.473 . . . . 0.88 110.895 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.462 HG22 HG23 ' A' ' 24' ' ' THR . 27.2 pt -93.15 16.91 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.634 0.605 . . . . 0.6 112.634 -178.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.79 43.18 18.84 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 116.059 -0.519 . . . . 0.66 113.411 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.423 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 15.2 m-85 -126.93 117.09 21.84 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 122.684 -0.304 . . . . 1.33 111.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.43 151.85 24.39 Favored 'General case' 0 CA--C 1.474 -1.956 0 N-CA-C 108.269 -1.011 . . . . 1.06 108.269 171.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.466 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 15.7 p -53.45 -30.35 40.15 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.616 0.969 . . . . 1.03 113.616 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.76 -54.59 36.84 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.625 -0.88 . . . . 1.56 108.625 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.06 80.16 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.053 0.541 . . . . 0.43 111.064 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.516 ' O ' ' HB ' ' A' ' 48' ' ' THR . 65.0 tp -64.3 -41.07 97.04 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.907 -0.588 . . . . 0.43 110.912 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 71.4 mtm -64.28 -31.73 73.05 Favored 'General case' 0 C--O 1.196 -1.723 0 O-C-N 122.026 -0.422 . . . . 1.49 111.541 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 9.3 tp10 -63.58 -33.03 74.7 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.731 0.777 . . . . 1.88 109.237 174.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 39.7 m -66.4 -55.32 16.36 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.398 -1.334 . . . . 0.45 107.398 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.06 -39.69 75.41 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-N 114.345 -1.298 . . . . 0.27 109.888 175.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.25 -45.98 86.79 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 123.775 0.83 . . . . 0.33 111.95 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 56.4 mtt180 -65.03 -37.15 86.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.707 -0.679 . . . . 2.84 109.908 178.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 13' ' ' ALA . 81.3 mt -65.59 -38.94 90.93 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 116.049 -0.523 . . . . 0.9 111.039 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.6 mt-10 -56.6 -55.08 38.5 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.626 0.579 . . . . 0.48 109.482 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 m -62.07 -40.61 96.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.518 -0.764 . . . . 1.19 112.136 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -66.09 -49.46 67.52 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.124 -0.489 . . . . 3.07 112.14 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -98.51 -11.16 22.54 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.947 1.462 . . . . 1.01 114.947 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.74 53.08 6.66 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.415 -0.898 . . . . 0.93 111.188 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.6 p -135.24 137.49 50.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 0 N-CA-C 108.448 -0.945 . . . . 1.16 108.448 -177.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.4 m -96.57 114.54 26.21 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 120.722 0.296 . . . . 1.87 110.7 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.2 mt -104.62 122.24 44.28 Favored Pre-proline 0 C--N 1.32 -0.695 0 C-N-CA 122.931 0.492 . . . . 0.57 109.969 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -67.78 131.73 24.95 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.956 2.437 . . . . 0.87 112.07 178.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -52.06 -40.51 61.26 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.848 1.259 . . . . 1.83 113.742 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.44 -37.85 83.63 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.901 -0.32 . . . . 2.34 110.533 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 34.0 t -75.23 -42.01 44.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.891 -0.781 . . . . 0.66 108.891 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.88 -32.05 69.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.603 -0.726 . . . . 0.51 111.386 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.87 9.68 63.97 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.73 -0.748 . . . . 0.61 112.273 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -100.41 -24.13 14.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.952 0.406 . . . . 3.98 110.292 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.536 HG21 HD23 ' A' ' 74' ' ' LEU . 20.8 m -75.68 103.88 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 CA-C-O 122.029 0.918 . . . . 0.44 111.032 -177.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.74 -30.32 20.4 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-N 115.132 -0.94 . . . . 1.91 111.488 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.4 p -122.51 145.53 45.04 Favored Pre-proline 0 N--CA 1.419 -1.981 0 CA-C-N 115.946 -0.57 . . . . 0.47 109.836 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.725 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.4 Cg_exo -53.07 -40.73 75.77 Favored 'Trans proline' 0 CA--C 1.509 -0.773 0 C-N-CA 124.023 3.148 . . . . 0.32 114.024 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.9 ptp85 -52.36 -39.78 61.17 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 123.495 0.497 . . . . 1.48 111.663 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.22 -51.55 63.15 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.933 -0.576 . . . . 2.13 109.837 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.536 HD23 HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -67.34 -39.76 85.83 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.619 -1.173 . . . . 0.9 110.213 -176.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.433 HD13 HD22 ' A' ' 10' ' ' LEU . 48.0 tp -56.91 -57.67 11.5 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 109.219 -0.659 . . . . 0.34 109.219 177.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.87 -37.86 74.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 123.766 0.666 . . . . 0.57 111.438 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -59.57 -53.08 62.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.682 -0.69 . . . . 1.96 110.439 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.465 HG22 HD13 ' A' ' 82' ' ' LEU . 44.9 mt -76.08 -21.92 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 C-N-CA 120.364 -0.534 . . . . 0.55 110.53 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -64.83 -50.29 67.28 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.853 -0.795 . . . . 1.14 108.853 173.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.66 -38.24 95.41 Favored Glycine 0 N--CA 1.439 -1.125 0 CA-C-N 115.249 -0.887 . . . . 0.53 111.668 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.75 -39.11 84.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.433 0.159 . . . . 0.6 110.845 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.604 ' HG ' ' HB1' ' A' ' 2' ' ' ALA . 5.3 mp -70.86 -39.01 73.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 122.357 0.263 . . . . 1.42 111.4 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.7 -34.14 77.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.567 0.698 . . . . 0.85 110.019 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -78.39 -20.14 51.84 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.458 -0.792 . . . . 2.44 110.145 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.82 -15.3 58.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.246 0.461 . . . . 2.12 112.246 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.319 0 N-CA-C 109.356 -0.609 . . . . 3.84 109.356 178.656 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.1 mmm . . . . . 0 CA--C 1.511 -0.545 0 N-CA-C 108.885 -0.783 . . . . 6.63 108.885 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.33 -67.21 0.6 Allowed 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.237 -0.653 . . . . 4.09 109.237 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 31.3 p -128.07 102.51 6.76 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 119.779 -0.769 . . . . 2.77 109.353 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.522 ' HA ' ' HG ' ' A' ' 82' ' ' LEU . 22.6 tp 151.42 156.7 0.0 OUTLIER 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 103.616 -2.735 . . . . 1.51 103.616 177.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.546 HD11 HD22 ' A' ' 52' ' ' LEU . 94.9 mt -117.35 124.22 48.39 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 108.157 -1.053 . . . . 0.8 108.157 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.9 p -97.6 -171.38 2.17 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 107.836 -1.172 . . . . 0.63 107.836 170.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.1 m -52.25 -54.98 24.33 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 123.891 0.876 . . . . 0.61 111.436 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.444 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . 32.1 t70 -72.07 -28.13 63.13 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 112.713 0.634 . . . . 1.65 112.713 -178.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.47 -44.98 85.45 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.573 -0.899 . . . . 1.41 108.573 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 30.9 tp -65.68 -47.39 75.63 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.626 -1.17 . . . . 0.48 108.881 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 36.7 ttt-85 -49.54 -51.51 36.13 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.343 1.057 . . . . 2.46 110.963 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 65.6 ttt180 -59.08 -50.58 73.54 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.435 -0.348 . . . . 3.93 111.581 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.26 -36.22 77.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.13 -0.486 . . . . 0.5 111.323 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.624 HD23 HG21 ' A' ' 48' ' ' THR . 99.1 mt -63.34 -53.52 51.37 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.523 0.514 . . . . 1.44 110.169 177.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.535 ' HA ' HG21 ' A' ' 21' ' ' THR . 94.6 t -57.97 -45.92 87.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.949 -0.569 . . . . 0.8 111.355 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.624 ' HB2' HH12 ' A' ' 51' ' ' ARG . 55.6 mt-10 -60.87 -30.46 70.15 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.503 -0.317 . . . . 2.05 111.723 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 m -89.77 -33.61 16.49 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.128 -0.229 . . . . 1.39 111.428 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.51 -29.85 52.66 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 120.813 0.339 . . . . 1.58 111.258 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.57 -82.77 1.65 Allowed Glycine 0 C--O 1.245 0.819 0 N-CA-C 110.846 -0.901 . . . . 2.32 110.846 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -98.08 111.9 24.05 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.468 -0.938 . . . . 5.17 108.468 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.535 HG21 ' HA ' ' A' ' 15' ' ' VAL . 4.2 t -156.19 109.3 2.66 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-O 122.587 1.184 . . . . 4.86 111.063 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -98.62 -59.58 1.71 Allowed 'General case' 0 C--N 1.282 -2.358 0 CA-C-N 113.858 -1.519 . . . . 4.5 107.719 174.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.71 -73.99 0.95 Allowed Glycine 0 N--CA 1.434 -1.499 0 CA-C-N 115.149 -0.932 . . . . 2.77 112.582 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t 176.74 -149.78 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 104.552 -2.388 . . . . 2.87 104.552 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -81.72 109.42 16.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 107.645 -1.243 . . . . 3.23 107.645 172.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.0 tp -96.54 -3.03 43.87 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.734 -1.121 . . . . 1.16 109.131 -174.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 p -81.0 140.18 35.34 Favored 'General case' 0 N--CA 1.416 -2.173 0 CA-C-N 114.331 -1.304 . . . . 1.46 110.953 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.19 -143.19 16.39 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.902 -0.879 . . . . 1.02 110.902 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -89.26 98.47 11.78 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 109.264 -0.643 . . . . 2.07 109.264 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -100.36 3.66 43.43 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.921 -0.77 . . . . 0.44 108.921 176.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.692 HD13 ' HB3' ' A' ' 72' ' ' ARG . 41.4 mt -54.2 -26.68 29.59 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.541 1.136 . . . . 0.39 113.99 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -90.32 -19.31 24.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.733 0.778 . . . . 2.04 110.445 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -81.96 123.71 29.12 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.317 -0.994 . . . . 1.37 108.317 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.63 146.0 42.79 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 116.278 -0.419 . . . . 3.94 110.292 -176.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.543 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 70.2 m-85 -61.94 -32.91 73.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.342 0.591 . . . . 0.35 109.543 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -54.72 -40.68 69.48 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.739 -1.119 . . . . 2.79 110.182 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -81.1 -33.34 33.39 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.941 -1.027 . . . . 0.88 111.06 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.5 pt -92.14 19.55 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 112.26 0.467 . . . . 0.6 112.26 -177.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 69.34 46.33 57.15 Favored Glycine 0 CA--C 1.511 -0.177 0 CA-C-N 116.122 -0.49 . . . . 0.66 113.626 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.543 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 7.7 m-85 -118.86 124.89 48.25 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 120.724 0.297 . . . . 1.33 111.502 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -84.7 134.1 34.36 Favored 'General case' 0 CA--C 1.484 -1.572 0 N-CA-C 107.709 -1.219 . . . . 1.06 107.709 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.505 ' O ' ' HB3' ' A' ' 45' ' ' LEU . 15.9 m -53.63 -26.12 20.72 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 123.607 0.567 . . . . 1.03 111.418 174.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.7 tp -64.7 -49.89 69.13 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.78 -0.575 . . . . 1.56 110.099 174.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.86 73.28 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 122.128 0.966 . . . . 0.43 109.702 177.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.624 HD21 HG23 ' A' ' 68' ' ' VAL . 33.8 tp -62.77 -50.64 70.23 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.49 -1.232 . . . . 0.43 108.957 176.446 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.9 mtp -62.56 -33.29 74.66 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.264 -0.425 . . . . 1.49 110.823 176.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.71 -36.59 81.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 122.159 0.981 . . . . 1.88 108.757 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.624 HG21 HD23 ' A' ' 14' ' ' LEU . 89.3 m -68.57 -57.65 5.44 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.245 -1.391 . . . . 0.45 107.245 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.619 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -54.82 -33.02 61.08 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.908 -1.496 . . . . 0.27 111.07 178.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.65 -46.92 83.57 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.154 0.502 . . . . 0.33 111.567 178.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.624 HH12 ' HB2' ' A' ' 16' ' ' GLU . 66.7 mtp180 -64.07 -37.79 88.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.307 -0.861 . . . . 2.84 109.634 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.619 HD12 ' HA ' ' A' ' 49' ' ' ALA . 65.1 mt -66.14 -47.97 72.31 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.9 110.295 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.9 mt-10 -58.43 -40.58 82.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.903 0.383 . . . . 0.48 110.246 175.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.8 t -61.26 -64.39 0.97 Allowed 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.203 -0.908 . . . . 1.19 111.005 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -63.86 -41.67 97.72 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.354 0.872 . . . . 3.07 113.354 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.443 ' HE1' ' HA ' ' A' ' 3' ' ' THR . 92.4 m-85 -93.2 -4.5 51.9 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 112.999 0.741 . . . . 1.01 112.999 -171.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.86 26.06 72.07 Favored Glycine 0 C--O 1.239 0.456 0 C-N-CA 120.981 -0.628 . . . . 0.93 112.562 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.791 HG12 ' HB3' ' A' ' 85' ' ' ALA . 28.9 m -99.15 173.96 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.937 -0.132 . . . . 1.16 110.749 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.2 p -141.9 113.68 7.91 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-O 121.421 0.629 . . . . 1.87 112.05 -176.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.488 HD12 ' HB1' ' A' ' 49' ' ' ALA . 63.4 mt -103.92 127.29 29.65 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 108.509 -0.923 . . . . 0.57 108.509 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.72 136.66 68.04 Favored 'Trans proline' 0 C--O 1.242 0.681 0 C-N-CA 122.37 2.047 . . . . 0.87 110.645 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -52.72 -41.87 64.35 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.902 0.704 . . . . 1.83 112.902 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.28 -32.51 72.72 Favored 'General case' 0 C--O 1.183 -2.429 0 CA-C-N 116.481 -0.327 . . . . 2.34 110.447 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.6 -44.74 46.6 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 N-CA-C 109.093 -0.706 . . . . 0.66 109.093 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.04 -35.37 66.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.531 0.732 . . . . 0.51 112.516 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.54 23.08 27.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.538 -0.839 . . . . 0.61 112.967 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -134.87 -0.28 2.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.8 0.81 . . . . 3.98 110.451 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.624 HG23 HD21 ' A' ' 45' ' ' LEU . 6.3 m -78.5 101.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.268 -1.012 . . . . 0.44 108.268 173.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -89.96 -30.52 17.75 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 114.49 -1.232 . . . . 1.91 110.295 -173.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.4 p -114.85 130.61 24.01 Favored Pre-proline 0 N--CA 1.403 -2.788 0 CA-C-N 115.085 -0.962 . . . . 0.47 109.914 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.645 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 86.4 Cg_exo -47.91 -46.74 20.85 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.095 3.197 . . . . 0.32 113.738 -175.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.692 ' HB3' HD13 ' A' ' 31' ' ' LEU . 18.2 ptt180 -54.33 -37.28 64.69 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 114.155 1.169 . . . . 1.48 114.155 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -66.54 -43.56 84.8 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.159 0.504 . . . . 2.13 110.976 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.486 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 3.2 tm? -69.22 -45.07 70.73 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.203 -0.908 . . . . 0.9 109.398 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.6 tp -56.31 -49.79 73.3 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 123.454 0.702 . . . . 0.34 109.411 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -57.23 -46.11 83.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.166 -0.925 . . . . 0.57 111.503 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -61.05 -47.12 87.83 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.241 -0.651 . . . . 1.96 109.241 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.492 HG21 HD12 ' A' ' 5' ' ' LEU . 58.3 mt -70.3 -27.98 33.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.795 0.331 . . . . 0.55 111.563 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -39.23 83.91 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 121.922 -0.486 . . . . 1.14 110.032 174.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.51 -39.58 91.09 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.772 -0.931 . . . . 0.53 110.772 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.28 87.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.677 0.275 . . . . 0.6 110.503 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.777 HD22 HG11 ' A' ' 58' ' ' VAL . 4.0 mm? -69.74 -27.57 65.06 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 111.878 0.325 . . . . 1.42 111.878 176.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.51 -33.26 75.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.471 0.653 . . . . 0.85 109.483 174.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -88.74 -57.35 2.94 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.26 -0.882 . . . . 2.44 112.958 -177.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.791 ' HB3' HG12 ' A' ' 58' ' ' VAL . . . -91.86 18.63 7.5 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 114.286 1.217 . . . . 2.12 114.286 -170.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -0.985 0 N-CA-C 108.668 -0.864 . . . . 3.84 108.668 174.453 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 mmt . . . . . 0 C--O 1.242 0.666 0 N-CA-C 112.017 0.377 . . . . 6.63 112.017 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.79 110.73 21.63 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.361 -0.977 . . . . 4.09 108.361 177.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.7 p -79.92 121.86 25.97 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.024 0.44 . . . . 2.77 110.252 -178.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB3' ' OD1' ' A' ' 79' ' ' ASN . 9.1 mp -64.22 160.4 18.64 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.819 0.819 . . . . 1.51 112.218 -179.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.463 HD11 ' CD1' ' A' ' 52' ' ' LEU . 38.6 mt -96.05 142.69 27.95 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.16 -0.927 . . . . 0.8 112.329 -167.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.8 p -101.99 -178.15 3.62 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.451 -1.685 . . . . 0.63 106.451 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.866 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.4 m -59.88 -32.92 71.17 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.315 0.578 . . . . 0.61 110.081 175.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.588 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 15.7 t70 -67.82 -42.76 81.0 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.627 -0.715 . . . . 1.65 110.043 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.419 ' HB3' HD22 ' A' ' 5' ' ' LEU . 6.9 m-20 -63.92 -38.29 90.53 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.55 -0.75 . . . . 1.41 109.476 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.4 tp -66.32 -45.68 79.46 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.182 -0.917 . . . . 0.48 109.844 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttp180 -52.41 -46.27 66.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.762 0.425 . . . . 2.46 111.024 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 94.4 mtt180 -54.66 -50.1 69.0 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.531 -0.759 . . . . 3.93 110.187 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.15 87.32 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.402 -0.817 . . . . 0.5 111.841 -175.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.02 -45.74 80.41 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.159 -0.216 . . . . 1.44 110.667 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.3 t -57.09 -40.33 72.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.151 0.5 . . . . 0.8 110.052 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 70.1 mm-40 -60.53 -40.08 90.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.741 -0.663 . . . . 2.05 111.408 177.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -81.29 -34.85 31.72 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 115.492 -0.776 . . . . 1.39 112.162 -174.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.3 -42.93 34.98 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.74 0.305 . . . . 1.58 111.558 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.55 145.26 13.92 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 109.414 -1.474 . . . . 2.32 109.414 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 70.59 147.09 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.191 0.996 . . . . 5.17 110.265 -176.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.9 t -88.48 -176.18 5.22 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 109.168 -0.679 . . . . 4.86 109.168 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.2 t70 50.59 79.0 0.09 Allowed 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.359 1.063 . . . . 4.5 111.199 -174.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.81 96.94 0.97 Allowed Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.236 -0.893 . . . . 2.77 112.183 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.4 p 43.06 -116.55 0.42 Allowed 'General case' 0 C--O 1.244 0.782 0 C-N-CA 125.528 1.531 . . . . 2.87 113.665 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -124.45 26.28 7.36 Favored 'General case' 0 C--N 1.281 -2.406 0 N-CA-C 106.414 -1.699 . . . . 3.23 106.414 177.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.3 tp -81.6 9.27 7.9 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.438 -1.256 . . . . 1.16 110.409 -175.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 p -76.55 138.55 40.26 Favored 'General case' 0 N--CA 1.423 -1.784 0 CA-C-N 115.408 -0.814 . . . . 1.46 110.812 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.74 -139.22 14.42 Favored Glycine 0 N--CA 1.429 -1.823 0 N-CA-C 110.407 -1.077 . . . . 1.02 110.407 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.866 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.4 t70 -105.35 105.36 15.36 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 109.104 -0.702 . . . . 2.07 109.104 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.463 ' HA ' HD23 ' A' ' 33' ' ' LEU . 28.2 p90 -105.4 19.4 20.64 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 116.049 -0.523 . . . . 0.44 111.161 -177.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.857 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 57.9 mt -52.19 -22.9 4.75 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.95 1.463 . . . . 0.39 114.95 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.97 -20.42 19.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.654 0.264 . . . . 2.04 111.513 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 30' ' ' PHE . 3.4 mm? -78.48 114.1 17.09 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-O 121.453 0.644 . . . . 1.37 109.587 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.596 ' HG2' HG22 ' A' ' 70' ' ' THR . 40.1 mtt180 -76.35 144.04 40.39 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.718 -1.128 . . . . 3.94 109.978 -172.028 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.597 ' HA ' HG12 ' A' ' 38' ' ' ILE . 44.1 m-85 -61.78 -41.9 98.3 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.369 -0.378 . . . . 0.35 110.993 -174.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -37.5 70.43 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.725 0.774 . . . . 2.79 110.338 176.075 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -81.09 -23.59 38.32 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.247 -0.888 . . . . 0.88 110.963 -174.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.597 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.2 pt -98.22 15.55 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.408 0.623 . . . . 0.6 111.788 177.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.32 36.9 38.06 Favored Glycine 0 C--O 1.226 -0.377 0 CA-C-N 115.823 -0.626 . . . . 0.66 113.967 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -113.0 127.58 56.27 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 122.305 -0.527 . . . . 1.33 111.356 177.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -86.05 145.37 27.1 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 106.304 -1.739 . . . . 1.06 106.304 172.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 46' ' ' MET . 34.1 p -52.55 -31.37 35.5 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 113.275 0.843 . . . . 1.03 113.275 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.69 -43.16 90.09 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.007 0.432 . . . . 1.56 110.108 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.415 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -64.32 -36.38 83.94 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 121.375 0.607 . . . . 0.43 109.392 175.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.556 ' O ' ' HB ' ' A' ' 48' ' ' THR . 50.6 tp -66.39 -40.14 89.49 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.3 -0.863 . . . . 0.43 111.621 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.533 ' HG3' ' O ' ' A' ' 42' ' ' SER . 60.6 mtt -64.5 -30.19 71.23 Favored 'General case' 0 C--O 1.207 -1.141 0 O-C-N 121.714 -0.616 . . . . 1.49 110.444 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 7.7 tp10 -61.65 -33.59 74.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 122.282 1.039 . . . . 1.88 108.742 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.556 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 55.8 m -67.92 -61.65 1.77 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.583 -1.644 . . . . 0.45 107.362 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -54.05 -34.54 60.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.319 -1.309 . . . . 0.27 111.026 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.15 -49.72 73.17 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 123.651 0.78 . . . . 0.33 111.896 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HA ' ' OG ' ' A' ' 54' ' ' SER . 92.8 mtt180 -67.3 -30.48 70.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.821 -0.627 . . . . 2.84 111.375 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 48' ' ' THR . 3.9 mm? -64.53 -46.59 82.23 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.47 -0.332 . . . . 0.9 110.198 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.582 ' HA ' HG12 ' A' ' 58' ' ' VAL . 44.4 mt-10 -57.09 -51.38 69.53 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 115.562 -0.745 . . . . 0.48 110.358 177.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.431 ' OG ' ' HA ' ' A' ' 51' ' ' ARG . 6.4 p -63.45 -52.46 61.34 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.501 0.926 . . . . 1.19 113.501 -178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.483 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 30.3 ttm180 -66.46 -49.84 65.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.809 0.67 . . . . 3.07 112.809 -177.096 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.483 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 99.6 m-85 -92.56 -17.36 24.53 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.056 0.762 . . . . 1.01 113.056 -170.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.15 68.14 1.44 Allowed Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.243 -0.979 . . . . 0.93 110.945 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 53' ' ' GLU . 10.8 p -141.61 176.1 4.64 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 N-CA-C 108.066 -1.087 . . . . 1.16 108.066 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.501 ' H ' HG22 ' A' ' 58' ' ' VAL . 4.4 p -140.68 107.36 5.35 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.345 0.593 . . . . 1.87 109.996 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.445 HD12 ' HB1' ' A' ' 49' ' ' ALA . 61.6 mt -105.99 111.81 64.38 Favored Pre-proline 0 C--N 1.31 -1.109 0 CA-C-N 115.227 -0.897 . . . . 0.57 109.197 -176.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -59.58 130.13 34.06 Favored 'Trans proline' 0 C--O 1.25 1.076 0 C-N-CA 122.629 2.22 . . . . 0.87 111.515 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -51.18 -39.46 56.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.306 1.442 . . . . 1.83 111.961 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.42 -39.02 85.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.496 -0.32 . . . . 2.34 111.292 -177.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.22 -39.54 42.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 109.041 -0.726 . . . . 0.66 109.041 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -36.69 73.88 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.904 -0.589 . . . . 0.51 111.096 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -88.65 4.83 85.08 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.015 -0.612 . . . . 0.61 112.349 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -102.78 -25.21 13.6 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 122.779 -0.248 . . . . 3.98 111.271 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 m -72.71 105.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.835 0.826 . . . . 0.44 109.933 -178.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.441 ' OD2' ' HD3' ' A' ' 34' ' ' ARG . 34.1 t70 -87.44 -24.28 24.21 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 114.722 -1.126 . . . . 1.91 110.807 -176.295 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.596 HG22 ' HG2' ' A' ' 34' ' ' ARG . 31.9 p -123.96 138.93 31.44 Favored Pre-proline 0 N--CA 1.418 -2.053 0 CA-C-N 115.685 -0.689 . . . . 0.47 110.705 -178.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.857 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.2 Cg_exo -54.73 -34.16 83.23 Favored 'Trans proline' 0 CA--C 1.514 -0.509 0 C-N-CA 123.669 2.913 . . . . 0.32 112.812 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.414 ' HG2' ' HB ' ' A' ' 70' ' ' THR . 3.9 ptp180 -51.8 -45.21 63.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 123.413 0.446 . . . . 1.48 111.966 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.38 -45.32 88.19 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 121.29 0.567 . . . . 2.13 110.483 178.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.05 -46.2 75.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.328 -0.851 . . . . 0.9 109.88 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.42 -46.08 83.93 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 116.216 -0.447 . . . . 0.34 109.803 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.11 -43.34 98.7 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.189 -0.914 . . . . 0.57 110.546 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.58 -52.28 66.08 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 123.568 0.747 . . . . 1.96 111.301 -177.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.7 mt -68.2 -46.62 80.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.558 0 C-N-CA 120.234 -0.586 . . . . 0.55 110.62 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.442 ' OD1' ' HB3' ' A' ' 4' ' ' LEU . 17.1 m-80 -55.99 -42.54 76.51 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 120.61 0.243 . . . . 1.14 110.575 177.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.12 -46.38 65.69 Favored Glycine 0 C--N 1.321 -0.304 0 CA-C-N 116.303 -0.408 . . . . 0.53 112.624 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.24 -35.91 80.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.705 0.288 . . . . 0.6 110.565 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.06 -39.45 79.12 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.376 -0.374 . . . . 1.42 111.138 176.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.55 -42.52 98.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.233 -0.44 . . . . 0.85 110.669 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -84.84 13.61 5.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.998 0.74 . . . . 2.44 112.998 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.07 73.42 6.36 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 107.975 -1.121 . . . . 2.12 107.975 173.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.587 0 CA-C-N 115.37 -0.832 . . . . 3.84 110.089 -176.529 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mtp . . . . . 0 CA--C 1.512 -0.483 0 N-CA-C 109.827 -0.435 . . . . 6.63 109.827 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.79 157.69 37.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.146 -0.686 . . . . 4.09 109.146 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 13.0 p -71.25 106.64 3.89 Favored 'General case' 0 CA--C 1.491 -1.325 0 CA-C-O 122.24 1.019 . . . . 2.77 109.175 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 79' ' ' ASN . 25.7 tp -70.07 161.66 29.71 Favored 'General case' 0 N--CA 1.398 -3.031 0 CA-C-N 112.892 -1.958 . . . . 1.51 109.805 -174.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.7 mt -92.52 128.48 38.39 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-N 115.855 -0.611 . . . . 0.8 111.051 -176.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.6 p -97.8 -176.35 3.44 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.409 -1.7 . . . . 0.63 106.409 168.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.4 m -57.81 -36.19 71.88 Favored 'General case' 0 C--N 1.312 -1.022 0 O-C-N 123.039 0.212 . . . . 0.61 110.626 174.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 11' ' ' ARG . 25.6 t70 -78.53 -32.71 48.09 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.076 0.465 . . . . 1.65 111.069 -177.301 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.46 -42.78 87.07 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.97 -0.752 . . . . 1.41 108.97 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.697 HD11 HD22 ' A' ' 74' ' ' LEU . 13.9 tp -66.54 -41.69 88.34 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.729 -1.123 . . . . 0.48 108.667 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 8' ' ' ASP . 72.6 ttt180 -48.32 -58.48 4.53 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.203 1.401 . . . . 2.46 111.601 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.54 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 62.3 mtp180 -58.18 -36.44 73.06 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 112.498 0.555 . . . . 3.93 112.498 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -45.2 95.3 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 123.377 0.423 . . . . 0.5 109.905 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.93 -42.36 90.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.344 -0.389 . . . . 1.44 111.799 177.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 11' ' ' ARG . 90.6 t -54.54 -51.71 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 121.029 0.442 . . . . 0.8 110.221 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.615 ' HA ' HG22 ' A' ' 21' ' ' THR . 13.7 mm-40 -63.72 -32.61 74.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.505 -0.77 . . . . 2.05 112.522 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -94.37 -2.86 51.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.745 0.646 . . . . 1.39 112.745 -175.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.21 -25.55 66.97 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.982 0.42 . . . . 1.58 110.91 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 137.57 -83.9 0.25 Allowed Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 120.767 -0.73 . . . . 2.32 112.259 177.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -95.11 24.29 5.03 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.189 0.596 . . . . 5.17 109.767 -175.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.615 HG22 ' HA ' ' A' ' 16' ' ' GLU . 59.2 p 52.24 49.49 20.44 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 123.402 1.573 . . . . 4.86 109.132 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -47.63 -57.3 5.65 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 111.086 -2.779 . . . . 4.5 111.617 -174.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.34 61.58 1.46 Allowed Glycine 0 N--CA 1.432 -1.606 0 C-N-CA 120.113 -1.042 . . . . 2.77 111.237 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.4 154.04 36.81 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 123.07 0.548 . . . . 2.87 109.877 177.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.84 82.36 2.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.881 1.324 . . . . 3.23 112.22 -175.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.649 ' HG ' ' CD2' ' A' ' 30' ' ' PHE . 6.0 mp -109.45 30.87 6.22 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 125.894 1.678 . . . . 1.16 108.053 -178.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.0 m -65.73 100.09 0.51 Allowed 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.593 -1.185 . . . . 1.46 113.704 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.88 -69.29 3.1 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.74 -0.663 . . . . 1.02 113.631 174.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -137.56 119.21 15.01 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.925 -0.398 . . . . 2.07 109.925 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.649 ' CD2' ' HG ' ' A' ' 26' ' ' LEU . 14.0 p90 -136.4 15.16 3.21 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.261 0.553 . . . . 0.44 110.075 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.644 HD23 ' HB2' ' A' ' 71' ' ' PRO . 60.1 mt -53.48 -24.16 12.25 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.183 1.549 . . . . 0.39 115.183 -177.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -95.36 -3.34 47.35 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.387 0.514 . . . . 2.04 112.387 -178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.498 ' O ' ' HD3' ' A' ' 71' ' ' PRO . 8.9 mp -80.63 138.81 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.394 -0.367 . . . . 1.37 110.698 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.11 141.37 35.83 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 109.785 -0.45 . . . . 3.94 109.785 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.433 ' HA ' HG12 ' A' ' 38' ' ' ILE . 50.4 m-85 -68.27 -42.91 78.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.362 0.601 . . . . 0.35 109.468 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.537 ' CD ' ' H ' ' A' ' 36' ' ' GLU . 1.5 mp0 -54.67 -34.96 63.04 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 124.655 1.182 . . . . 2.79 109.921 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -79.32 -31.39 43.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.564 -1.198 . . . . 0.88 111.124 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.54 HG13 ' CD1' ' A' ' 40' ' ' TYR . 31.0 pt -93.21 15.78 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 120.485 -0.486 . . . . 0.6 111.572 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.19 34.36 17.76 Favored Glycine 0 C--O 1.238 0.382 0 CA-C-N 115.732 -0.667 . . . . 0.66 114.127 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.54 ' CD1' HG13 ' A' ' 38' ' ' ILE . 9.1 m-85 -116.45 123.16 46.82 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 122.598 -0.354 . . . . 1.33 111.264 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.09 151.16 24.35 Favored 'General case' 0 CA--C 1.48 -1.726 0 N-CA-C 106.439 -1.689 . . . . 1.06 106.439 171.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.3 p -53.51 -34.63 58.81 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 113.076 0.769 . . . . 1.03 113.076 179.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.71 -45.95 77.1 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 109.307 -0.627 . . . . 1.56 109.307 177.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.78 94.9 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.474 0.654 . . . . 0.43 109.846 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.606 HD21 HG23 ' A' ' 68' ' ' VAL . 56.7 tp -62.19 -40.16 95.15 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.686 -1.143 . . . . 0.43 110.175 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 81.9 mtp -63.99 -33.15 75.09 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.213 -0.449 . . . . 1.49 111.489 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.91 -29.3 70.23 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.492 0.663 . . . . 1.88 109.995 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 24.7 m -64.8 -61.86 1.92 Allowed 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.912 -1.514 . . . . 0.45 106.912 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.2 -36.06 70.39 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.776 -1.556 . . . . 0.27 110.655 177.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.5 -45.9 87.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.19 0.596 . . . . 0.33 111.96 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.53 -37.52 86.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.852 -0.613 . . . . 2.84 110.222 177.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 96.7 mt -64.38 -43.08 95.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.194 -0.457 . . . . 0.9 110.667 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 40.4 mt-10 -57.0 -54.05 51.16 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 109.936 -0.394 . . . . 0.48 109.936 175.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.4 m -61.55 -39.7 92.05 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.912 -1.04 . . . . 1.19 111.783 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.505 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 32.1 ttm180 -67.53 -50.55 58.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.27 -0.423 . . . . 3.07 111.733 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.505 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 89.9 m-85 -96.92 -22.91 16.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.691 1.367 . . . . 1.01 114.691 -171.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.63 21.66 33.58 Favored Glycine 0 C--N 1.306 -1.113 0 C-N-CA 119.937 -1.125 . . . . 0.93 112.461 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.02 137.41 26.55 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 N-CA-C 108.645 -0.872 . . . . 1.16 108.645 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.0 m -98.34 113.23 25.13 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.044 0.449 . . . . 1.87 110.866 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.6 mt -99.35 125.24 41.94 Favored Pre-proline 0 C--N 1.31 -1.125 0 CA-C-N 116.251 -0.432 . . . . 0.57 110.026 -178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.415 ' HB2' HG23 ' A' ' 64' ' ' VAL . 36.5 Cg_exo -62.77 116.01 3.28 Favored 'Trans proline' 0 C--O 1.243 0.74 0 C-N-CA 122.2 1.933 . . . . 0.87 110.044 175.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -55.24 -24.25 26.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.92 0.888 . . . . 1.83 113.059 -177.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.84 -43.94 74.47 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.175 0.512 . . . . 2.34 110.007 176.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 61' ' ' PRO . 32.6 t -74.55 -34.71 36.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 109.142 -0.688 . . . . 0.66 109.142 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.7 -24.5 61.52 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.726 -0.67 . . . . 0.51 111.976 178.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -0.11 48.36 Favored Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.548 -0.834 . . . . 0.61 112.449 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -100.62 -12.81 18.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.184 0.516 . . . . 3.98 110.606 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.606 HG23 HD21 ' A' ' 45' ' ' LEU . 19.0 m -74.04 115.96 15.84 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.296 0 CA-C-O 121.635 0.731 . . . . 0.44 110.576 -177.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.98 -49.85 6.53 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 114.637 -1.165 . . . . 1.91 109.701 -176.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.528 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 26.5 p -118.15 157.31 49.18 Favored Pre-proline 0 N--CA 1.406 -2.671 0 CA-C-N 114.775 -1.102 . . . . 0.47 109.314 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.644 ' HB2' HD23 ' A' ' 31' ' ' LEU . 49.2 Cg_exo -58.49 -27.28 81.59 Favored 'Trans proline' 0 CA--C 1.5 -1.202 0 C-N-CA 123.591 2.861 . . . . 0.32 112.657 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -52.97 -48.64 67.27 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.602 0.564 . . . . 1.48 110.002 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.68 -47.61 80.53 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 114.626 -1.17 . . . . 2.13 109.828 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -67.19 -50.27 61.6 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.853 -1.067 . . . . 0.9 110.144 -175.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' A' ' 79' ' ' ASN . 59.7 tp -55.85 -52.1 65.2 Favored 'General case' 0 C--O 1.206 -1.198 0 O-C-N 123.61 0.569 . . . . 0.34 110.389 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.04 -37.3 82.13 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 123.69 0.619 . . . . 0.57 112.03 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.98 -52.27 64.68 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.314 -0.403 . . . . 1.96 109.945 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.7 mt -70.67 -44.49 76.51 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.902 0 C-N-CA 120.223 -0.591 . . . . 0.55 109.932 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.48 ' HA ' HD11 ' A' ' 4' ' ' LEU . 6.7 t-20 -49.52 -53.59 22.62 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 123.735 0.814 . . . . 1.14 110.755 -175.38 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.84 94.67 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.985 -0.626 . . . . 0.53 112.696 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.72 -33.94 73.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.12 0.486 . . . . 0.6 111.607 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.414 HD23 HD12 ' A' ' 4' ' ' LEU . 26.3 tp -78.68 -31.91 46.86 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 123.835 0.854 . . . . 1.42 110.051 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.02 96.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.569 0.7 . . . . 0.85 109.764 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.81 8.28 20.6 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.318 -0.856 . . . . 2.44 111.679 -178.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.66 116.48 24.8 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.599 -0.519 . . . . 2.12 109.599 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.295 -1.776 0 N-CA-C 107.386 -1.338 . . . . 3.84 107.386 179.12 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.1 mmm . . . . . 0 CA--C 1.51 -0.564 0 N-CA-C 108.945 -0.761 . . . . 6.63 108.945 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.06 -176.49 5.97 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 107.487 -1.301 . . . . 4.09 107.487 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -72.13 106.46 4.37 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 122.624 1.202 . . . . 2.77 109.591 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.501 HD11 ' HA ' ' A' ' 79' ' ' ASN . 46.4 tp -130.56 166.92 19.58 Favored 'General case' 0 N--CA 1.402 -2.848 0 CA-C-N 113.471 -1.695 . . . . 1.51 107.326 -175.314 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.405 HD11 HD22 ' A' ' 52' ' ' LEU . 96.0 mt -84.11 122.45 28.83 Favored 'General case' 0 C--N 1.289 -2.056 0 C-N-CA 120.422 -0.511 . . . . 0.8 109.8 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.4 p -102.1 -173.92 2.45 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.239 -1.393 . . . . 0.63 107.239 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.9 m -58.36 -43.3 88.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.75 -0.833 . . . . 0.61 108.75 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.9 -47.1 87.96 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.76 -1.109 . . . . 1.65 110.943 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.27 -39.02 89.14 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 116.091 -0.504 . . . . 1.41 110.771 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.436 HD11 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -66.03 -41.59 90.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 0.48 110.02 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -53.31 -54.73 32.19 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.878 0.871 . . . . 2.46 109.634 175.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -58.72 -38.85 79.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.491 -1.231 . . . . 3.93 111.42 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.96 82.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.08 -0.509 . . . . 0.5 111.536 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.74 HD23 HG21 ' A' ' 48' ' ' THR . 94.8 mt -63.67 -44.58 93.32 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.219 0.533 . . . . 1.44 109.97 178.2 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.0 t -62.77 -50.62 79.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.395 -0.82 . . . . 0.8 109.103 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -59.72 -25.05 64.5 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 2.05 113.167 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.631 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 27.5 m -90.52 -29.99 17.55 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.81 0.338 . . . . 1.39 111.721 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.48 -32.06 54.06 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.667 -0.864 . . . . 1.58 108.667 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.88 -63.54 0.34 Allowed Glycine 0 CA--C 1.481 -2.093 0 N-CA-C 107.766 -2.134 . . . . 2.32 107.766 -177.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -157.75 148.29 20.85 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 106.487 -1.671 . . . . 5.17 106.487 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -155.49 -161.53 1.19 Allowed 'General case' 0 C--N 1.29 -2.008 0 N-CA-C 109.514 -0.55 . . . . 4.86 109.514 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.12 -53.05 3.78 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.953 -0.758 . . . . 4.5 108.953 178.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.25 44.26 6.31 Favored Glycine 0 N--CA 1.432 -1.618 0 N-CA-C 109.448 -1.461 . . . . 2.77 109.448 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 t -52.05 93.07 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.266 1.426 . . . . 2.87 113.209 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 63.51 25.54 14.47 Favored 'General case' 0 CA--C 1.501 -0.924 0 C-N-CA 124.19 0.996 . . . . 3.23 110.737 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.418 HD21 HD12 ' A' ' 14' ' ' LEU . 9.7 tp -76.78 -25.48 53.4 Favored 'General case' 0 C--O 1.248 0.987 0 CA-C-N 114.854 -1.066 . . . . 1.16 108.293 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.2 m -67.57 135.68 53.31 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.509 -1.223 . . . . 1.46 108.581 176.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.83 -131.85 10.75 Favored Glycine 0 N--CA 1.435 -1.377 0 N-CA-C 110.671 -0.972 . . . . 1.02 110.671 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -120.06 104.98 10.58 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.85 -0.796 . . . . 2.07 108.85 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.433 ' HA ' HD13 ' A' ' 33' ' ' LEU . 19.6 p90 -108.96 12.55 25.26 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 120.198 -0.601 . . . . 0.44 110.734 -178.06 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.568 HD23 ' HB2' ' A' ' 71' ' ' PRO . 57.2 mt -51.45 -28.63 13.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.834 1.79 . . . . 0.39 115.834 -176.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -96.73 -6.79 35.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.489 0.661 . . . . 2.04 111.534 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.9 mp -79.82 129.68 34.69 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 121.875 -0.516 . . . . 1.37 110.122 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.76 137.78 39.51 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 109.455 -0.572 . . . . 3.94 109.455 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -58.54 -49.72 76.38 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 123.69 0.619 . . . . 0.35 110.23 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -57.28 -27.37 62.06 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.466 0.479 . . . . 2.79 111.697 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -81.74 -32.22 31.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.752 0.31 . . . . 0.88 110.315 -176.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.5 pt -93.72 23.18 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 112.224 0.453 . . . . 0.6 112.224 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 78.44 14.88 81.69 Favored Glycine 0 C--O 1.24 0.507 0 C-N-CA 121.118 -0.563 . . . . 0.66 113.855 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -103.36 125.77 50.16 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.007 0.432 . . . . 1.33 111.097 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -87.46 138.48 31.44 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 108.195 -1.039 . . . . 1.06 108.195 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.3 p -51.4 -33.09 28.74 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 123.718 0.636 . . . . 1.03 112.33 173.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.77 -48.66 71.07 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.199 -0.667 . . . . 1.56 109.199 177.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.21 -34.09 76.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.464 0.649 . . . . 0.43 109.949 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.454 ' O ' ' HB ' ' A' ' 48' ' ' THR . 64.2 tp -63.13 -33.49 75.57 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.0 -1.0 . . . . 0.43 111.188 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.9 mtm -64.24 -33.81 76.66 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.413 -0.515 . . . . 1.49 110.775 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.08 -34.05 77.49 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-O 121.631 0.729 . . . . 1.88 109.556 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.74 HG21 HD23 ' A' ' 14' ' ' LEU . 37.2 m -66.21 -57.51 7.43 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.843 -1.169 . . . . 0.45 107.843 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.528 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.5 -36.17 66.38 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 113.963 -1.471 . . . . 0.27 109.595 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.16 -44.4 87.9 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 123.085 0.554 . . . . 0.33 112.279 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 38.0 mtp180 -66.19 -34.24 77.59 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.382 0.611 . . . . 2.84 109.975 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 49' ' ' ALA . 94.5 mt -65.71 -44.9 84.7 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.575 -0.739 . . . . 0.9 109.977 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.65 ' HA ' HG12 ' A' ' 58' ' ' VAL . 47.2 mt-10 -58.1 -44.17 87.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.48 109.927 174.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -61.3 -59.63 5.0 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.496 -1.229 . . . . 1.19 110.817 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -66.12 -41.94 89.83 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.77 1.026 . . . . 3.07 113.77 -177.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -95.26 -17.88 21.32 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.97 1.1 . . . . 1.01 113.97 -172.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.21 65.79 1.89 Allowed Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.012 -1.09 . . . . 0.93 110.858 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.65 HG12 ' HA ' ' A' ' 53' ' ' GLU . 10.6 p -140.63 176.18 5.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 107.969 -1.123 . . . . 1.16 107.969 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.476 ' H ' HG22 ' A' ' 58' ' ' VAL . 22.2 p -140.96 105.47 4.87 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.594 0.711 . . . . 1.87 110.01 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.407 HD12 ' HB1' ' A' ' 49' ' ' ALA . 73.7 mt -96.9 122.5 56.47 Favored Pre-proline 0 C--N 1.291 -1.955 0 CA-C-N 115.738 -0.664 . . . . 0.57 109.543 -174.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.89 128.47 26.87 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.715 2.277 . . . . 0.87 111.531 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -52.97 -37.78 61.5 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.777 1.231 . . . . 1.83 111.435 -178.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.54 -40.98 85.02 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 115.088 -0.96 . . . . 2.34 110.492 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.692 HG11 ' HG ' ' A' ' 77' ' ' LEU . 61.4 t -74.54 -45.05 46.54 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.221 -0.659 . . . . 0.66 109.221 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.23 -36.89 66.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.51 111.861 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.73 22.66 34.92 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.302 -0.952 . . . . 0.61 112.782 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -135.03 4.66 3.26 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.821 0.82 . . . . 3.98 110.162 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 m -82.01 124.08 38.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.009 -0.737 . . . . 0.44 109.009 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.37 -40.09 13.82 Favored 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 120.993 -0.283 . . . . 1.91 111.641 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 33.3 p -119.55 151.32 51.54 Favored Pre-proline 0 N--CA 1.417 -2.085 0 O-C-N 123.324 0.39 . . . . 0.47 110.672 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.568 ' HB2' HD23 ' A' ' 31' ' ' LEU . 68.6 Cg_exo -55.38 -32.24 80.8 Favored 'Trans proline' 0 C--O 1.206 -1.079 0 C-N-CA 123.657 2.905 . . . . 0.32 112.097 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.0 ttm105 -52.28 -48.26 65.41 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.769 0.668 . . . . 1.48 110.154 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -63.78 -48.9 75.09 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.95 0.9 . . . . 2.13 110.949 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.436 HD12 HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -66.48 -44.95 81.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.023 -0.99 . . . . 0.9 110.407 -176.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.7 tp -57.78 -47.22 83.18 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.135 0.574 . . . . 0.34 109.974 178.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.2 -47.71 80.58 Favored 'General case' 0 CA--C 1.506 -0.734 0 O-C-N 123.822 0.701 . . . . 0.57 111.689 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.692 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -59.66 -48.89 79.88 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 124.011 0.82 . . . . 1.96 109.872 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.9 mt -69.24 -39.22 78.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 116.164 -0.471 . . . . 0.55 110.541 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.501 ' HA ' HD11 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -60.65 -43.46 97.58 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.917 -0.129 . . . . 1.14 111.098 177.492 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.79 -42.59 98.47 Favored Glycine 0 N--CA 1.448 -0.531 0 O-C-N 123.481 0.488 . . . . 0.53 111.924 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.88 -42.9 72.85 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.072 0.463 . . . . 0.6 110.716 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.14 -14.61 62.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.881 0.697 . . . . 1.42 112.881 179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.84 67.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.468 0.652 . . . . 0.85 109.686 173.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -91.07 4.45 52.11 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-N 115.828 -0.624 . . . . 2.44 110.757 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -95.34 142.86 27.24 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.613 -0.514 . . . . 2.12 109.613 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.623 0 N-CA-C 108.818 -0.808 . . . . 3.84 108.818 -178.783 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.5 mtm . . . . . 0 CA--C 1.503 -0.846 0 N-CA-C 109.057 -0.72 . . . . 6.63 109.057 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.15 24.58 2.13 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.642 -0.503 . . . . 4.09 109.642 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.834 ' HA ' ' HE1' ' A' ' 56' ' ' TYR . 8.5 t -122.53 103.67 8.85 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.265 1.031 . . . . 2.77 111.157 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 3' ' ' THR . 30.1 tp 156.55 160.37 0.01 OUTLIER 'General case' 0 N--CA 1.419 -1.995 0 C-N-CA 128.321 2.649 . . . . 1.51 105.059 172.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 88.5 mt -122.86 123.03 40.08 Favored 'General case' 0 C--N 1.284 -2.243 0 N-CA-C 108.251 -1.018 . . . . 0.8 108.251 173.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.0 p -101.54 -170.47 1.83 Allowed 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 107.841 -1.17 . . . . 0.63 107.841 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.548 HG21 ' HA ' ' A' ' 29' ' ' ASP . 3.3 m -54.58 -54.57 39.62 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 123.294 0.638 . . . . 0.61 111.407 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -73.08 -28.47 62.31 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.703 -0.399 . . . . 1.65 111.805 -176.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.88 -38.56 86.53 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 108.636 -0.875 . . . . 1.41 108.636 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 75' ' ' LEU . 14.2 tp -66.48 -45.62 79.04 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.225 -0.898 . . . . 0.48 108.671 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.548 ' O ' HG23 ' A' ' 15' ' ' VAL . 2.5 tmt_? -50.62 -51.43 48.8 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.12 0.968 . . . . 2.46 109.709 175.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -57.72 -42.25 83.43 Favored 'General case' 0 C--N 1.313 -1.013 0 C-N-CA 124.824 1.249 . . . . 3.93 110.883 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.84 99.91 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 115.467 -0.788 . . . . 0.5 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.62 HD12 HG21 ' A' ' 48' ' ' THR . 11.1 mp -63.79 -41.64 97.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.98 -0.554 . . . . 1.44 111.133 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 11' ' ' ARG . 66.8 t -56.35 -55.98 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.526 -0.546 . . . . 0.8 109.526 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.407 ' HB3' ' NH1' ' A' ' 51' ' ' ARG . 34.5 mm-40 -54.91 -49.11 72.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.517 -0.765 . . . . 2.05 111.968 -178.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.5 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 4.0 m -77.28 -9.33 58.75 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.27 0.47 . . . . 1.39 112.27 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -98.64 -1.63 40.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.029 0.442 . . . . 1.58 110.781 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.65 17.71 57.92 Favored Glycine 0 C--N 1.317 -0.527 0 C-N-CA 119.994 -1.098 . . . . 2.32 111.303 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.448 ' HG2' HG12 ' A' ' 15' ' ' VAL . 39.4 mt-10 60.18 67.56 0.84 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.675 1.19 . . . . 5.17 112.675 177.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.52 -148.78 0.14 Allowed 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 108.989 -0.745 . . . . 4.86 108.989 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -92.93 -35.42 13.33 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.33 -0.856 . . . . 4.5 109.104 177.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.52 4.93 65.49 Favored Glycine 0 C--O 1.219 -0.801 0 CA-C-O 119.11 -0.828 . . . . 2.77 113.959 175.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.3 t 46.48 51.04 12.19 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.568 1.147 . . . . 2.87 111.305 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 60.57 80.19 0.22 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 113.951 -1.477 . . . . 3.23 110.087 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.413 ' HG ' ' HG2' ' A' ' 11' ' ' ARG . 18.7 tp -107.79 -23.21 12.17 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 113.869 -1.514 . . . . 1.16 109.781 -173.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.5 m -59.0 125.11 22.27 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.429 -0.805 . . . . 1.46 112.521 -174.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.38 -139.89 14.74 Favored Glycine 0 N--CA 1.43 -1.712 0 CA-C-N 115.899 -0.591 . . . . 1.02 112.649 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.548 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.3 t70 -85.45 102.52 13.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.15 0.5 . . . . 2.07 110.251 -178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -115.82 13.29 16.07 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.683 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.784 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 48.6 mt -51.66 -21.68 2.84 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.687 1.736 . . . . 0.39 115.687 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -90.74 -21.63 21.47 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.181 0.515 . . . . 2.04 111.531 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mp -77.86 117.92 19.68 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 116.079 -0.51 . . . . 1.37 110.084 -175.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -71.92 144.84 48.82 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.648 -0.871 . . . . 3.94 108.648 -176.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.476 ' HA ' HG12 ' A' ' 38' ' ' ILE . 66.9 m-85 -57.26 -45.69 83.76 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.37 0.508 . . . . 0.35 112.37 -175.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.8 -31.19 70.58 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.712 0.767 . . . . 2.79 111.37 178.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -81.54 -17.82 47.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.242 -0.89 . . . . 0.88 109.939 -175.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.476 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.1 pt -101.8 14.47 5.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.381 0.61 . . . . 0.6 111.622 173.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.4 18.71 77.62 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.636 -0.711 . . . . 0.66 114.153 175.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -98.84 128.15 44.97 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 122.422 -0.457 . . . . 1.33 111.788 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -88.72 151.05 22.66 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.991 -1.114 . . . . 1.06 107.991 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.552 ' O ' ' HG3' ' A' ' 46' ' ' MET . 60.7 p -53.99 -28.38 37.51 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.456 0.539 . . . . 1.03 112.456 175.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.63 -58.6 6.95 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.365 -0.606 . . . . 1.56 109.365 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.095 0.474 . . . . 0.43 110.577 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.493 ' O ' ' HB ' ' A' ' 48' ' ' THR . 57.6 tp -62.54 -45.18 94.14 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.523 -0.762 . . . . 0.43 110.818 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.552 ' HG3' ' O ' ' A' ' 42' ' ' SER . 61.7 mtt -63.65 -40.71 97.55 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.6 0.238 . . . . 1.49 110.544 177.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.07 -29.02 70.19 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.767 0.794 . . . . 1.88 111.055 177.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.62 HG21 HD12 ' A' ' 14' ' ' LEU . 92.3 m -65.91 -54.8 21.71 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.152 -1.425 . . . . 0.45 107.152 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.523 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.6 -33.79 68.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.816 -1.538 . . . . 0.27 110.73 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.435 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -57.33 -46.99 82.72 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.408 0.683 . . . . 0.33 112.275 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.407 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 47.3 mtp180 -64.63 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.369 0.604 . . . . 2.84 109.782 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 49' ' ' ALA . 83.0 mt -66.67 -43.25 85.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.416 -0.811 . . . . 0.9 110.221 177.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.5 mt-10 -55.18 -53.74 52.12 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.175 -0.676 . . . . 0.48 109.175 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -62.64 -42.54 99.66 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.062 -0.972 . . . . 1.19 112.609 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.06 -42.71 93.95 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.488 0.551 . . . . 3.07 112.488 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.834 ' HE1' ' HA ' ' A' ' 3' ' ' THR . 69.3 m-85 -96.4 -0.23 49.59 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 113.932 1.086 . . . . 1.01 113.932 -173.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 67.64 48.27 57.27 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 111.241 -0.744 . . . . 0.93 111.241 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 59' ' ' SER . 12.7 p -139.01 176.01 6.92 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 N-CA-C 107.612 -1.255 . . . . 1.16 107.612 -177.279 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.412 ' H ' HG22 ' A' ' 58' ' ' VAL . 16.2 t -142.17 143.41 32.95 Favored 'General case' 0 N--CA 1.421 -1.905 0 N-CA-C 108.808 -0.812 . . . . 1.87 108.808 175.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.523 HD12 ' HB1' ' A' ' 49' ' ' ALA . 64.6 mt -121.82 123.39 27.43 Favored Pre-proline 0 C--N 1.296 -1.735 0 N-CA-C 107.417 -1.327 . . . . 0.57 107.417 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.07 138.91 81.31 Favored 'Trans proline' 0 C--O 1.254 1.278 0 C-N-CA 122.356 2.038 . . . . 0.87 111.158 177.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -53.54 -38.69 64.04 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.877 0.871 . . . . 1.83 111.296 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.53 -33.88 75.96 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.407 -0.361 . . . . 2.34 111.247 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 81.2 t -73.1 -50.17 33.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 N-CA-C 108.083 -1.081 . . . . 0.66 108.083 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.62 -26.35 61.44 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.198 -0.91 . . . . 0.51 112.396 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.89 0.98 51.81 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.615 -0.802 . . . . 0.61 113.635 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -98.63 -16.3 19.12 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 117.779 0.789 . . . . 3.98 110.631 -178.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.554 HG21 HD23 ' A' ' 74' ' ' LEU . 23.1 m -74.41 113.44 12.86 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-N 115.508 -0.769 . . . . 0.44 109.81 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -89.66 -39.03 13.47 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-N 115.553 -0.748 . . . . 1.91 111.801 -177.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 37.3 p -115.65 150.77 45.33 Favored Pre-proline 0 N--CA 1.416 -2.134 0 CA-C-N 115.675 -0.693 . . . . 0.47 109.969 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.784 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.2 Cg_exo -53.99 -40.45 81.03 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.623 2.882 . . . . 0.32 114.502 -178.161 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -36.48 64.13 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.698 0.681 . . . . 1.48 111.677 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -62.6 -53.54 53.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.274 -0.639 . . . . 2.13 109.274 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.554 HD23 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -65.38 -46.43 80.12 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.9 110.051 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.537 ' HB2' HD22 ' A' ' 10' ' ' LEU . 43.4 tp -58.17 -52.82 63.97 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.077 -0.51 . . . . 0.34 111.064 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.93 -39.37 93.4 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.012 0.375 . . . . 0.57 112.012 -176.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.21 -42.54 99.4 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.645 0.26 . . . . 1.96 111.236 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.26 -43.23 65.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 110.022 -0.362 . . . . 0.55 110.022 178.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -52.61 -47.23 67.1 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.713 0.405 . . . . 1.14 111.328 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.31 -44.19 96.73 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.628 -0.589 . . . . 0.53 111.628 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.95 74.78 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 122.814 0.446 . . . . 0.6 111.07 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 78.6 mt -67.74 -39.36 84.25 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 122.754 0.422 . . . . 1.42 110.352 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.81 -31.62 72.93 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.755 -0.657 . . . . 0.85 110.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -75.91 -37.85 58.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.999 -0.546 . . . . 2.44 110.806 176.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.93 -51.62 37.99 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.918 -0.583 . . . . 2.12 111.477 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.422 0 CA-C-O 119.176 -0.44 . . . . 3.84 109.845 -177.975 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 C--O 1.24 0.563 0 CA-C-O 120.564 0.221 . . . . 6.63 110.678 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.06 79.45 5.18 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.685 0.755 . . . . 4.09 110.851 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 36.2 m -103.53 117.72 35.09 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 114.828 -1.078 . . . . 2.77 109.726 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 82' ' ' LEU . 10.1 mp -79.42 154.89 28.62 Favored 'General case' 0 CA--C 1.486 -1.512 0 CA-C-O 121.538 0.685 . . . . 1.51 110.792 177.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 52' ' ' LEU . 38.9 mt -89.56 126.37 35.58 Favored 'General case' 0 C--N 1.273 -2.723 0 CA-C-N 114.385 -1.28 . . . . 0.8 109.873 -173.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.5 p -99.42 -170.13 1.86 Allowed 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 107.06 -1.459 . . . . 0.63 107.06 169.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 m -52.37 -54.21 34.81 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 118.399 0.545 . . . . 0.61 111.385 -178.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -64.43 -41.81 96.37 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 116.163 -0.471 . . . . 1.65 111.71 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -65.47 -43.5 90.07 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 121.185 0.517 . . . . 1.41 110.046 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.748 HD11 HD22 ' A' ' 74' ' ' LEU . 40.9 tp -65.58 -44.4 86.81 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.393 -0.821 . . . . 0.48 109.776 -178.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' O ' HG23 ' A' ' 15' ' ' VAL . 36.9 ttm105 -52.29 -44.4 65.0 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.709 0.631 . . . . 2.46 110.93 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 75.9 ttt180 -56.37 -40.05 73.94 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.531 0.519 . . . . 3.93 111.192 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.31 -37.48 85.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.711 0.291 . . . . 0.5 110.524 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.559 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.53 -34.28 77.56 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.192 -0.458 . . . . 1.44 110.28 175.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 11' ' ' ARG . 28.3 t -73.13 -29.79 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.415 0.626 . . . . 0.8 109.826 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 22.2 mm-40 -61.16 -53.11 61.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.457 -0.792 . . . . 2.05 110.168 177.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 p -75.76 -32.38 59.93 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.061 0.393 . . . . 1.39 112.061 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.57 26.7 1.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.363 0.601 . . . . 1.58 110.164 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.22 -8.52 47.07 Favored Glycine 0 N--CA 1.429 -1.821 0 N-CA-C 109.979 -1.248 . . . . 2.32 109.979 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -117.28 89.28 3.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.237 -1.023 . . . . 5.17 108.237 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.1 m 72.2 123.27 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.972 1.309 . . . . 4.86 110.45 -176.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 77.88 171.98 0.2 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 125.543 1.537 . . . . 4.5 110.613 -171.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.88 67.2 0.04 OUTLIER Glycine 0 CA--C 1.459 -3.463 0 C-N-CA 120.522 -0.847 . . . . 2.77 111.81 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -58.28 122.71 13.88 Favored 'General case' 0 N--CA 1.404 -2.763 0 CA-C-N 113.084 -1.558 . . . . 2.87 110.054 176.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -63.26 108.52 1.31 Allowed 'General case' 0 C--O 1.24 0.578 0 N-CA-C 108.507 -0.923 . . . . 3.23 108.507 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.6 tp -116.38 18.7 15.1 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.359 -0.837 . . . . 1.16 110.572 -170.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.405 ' HA ' ' HD3' ' A' ' 11' ' ' ARG . 13.0 p -62.61 137.87 58.36 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.362 -0.835 . . . . 1.46 111.954 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.95 -157.97 19.63 Favored Glycine 0 N--CA 1.435 -1.39 0 CA-C-N 115.72 -0.673 . . . . 1.02 112.795 178.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -87.98 104.88 17.05 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 123.261 0.624 . . . . 2.07 110.003 -179.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.401 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 10.2 p90 -113.23 13.08 19.13 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.785 -0.643 . . . . 0.44 111.207 -175.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.678 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 38.5 mt -52.11 -25.23 8.34 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.608 1.707 . . . . 0.39 115.608 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -100.24 -10.26 21.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 2.04 111.121 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -79.97 119.79 23.29 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.805 -0.443 . . . . 1.37 109.805 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.89 151.1 38.97 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.161 -0.472 . . . . 3.94 109.862 -175.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.633 ' HA ' HG12 ' A' ' 38' ' ' ILE . 68.9 m-85 -68.53 -37.07 79.68 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 116.305 -0.407 . . . . 0.35 110.585 -176.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -57.85 -29.26 64.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.165 0.507 . . . . 2.79 110.969 175.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -83.11 -31.46 27.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.711 -0.677 . . . . 0.88 111.22 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.633 HG12 ' HA ' ' A' ' 35' ' ' PHE . 34.9 pt -93.84 24.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.185 0.517 . . . . 0.6 111.922 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 36.24 91.03 Favored Glycine 0 N--CA 1.453 -0.183 0 CA-C-N 115.292 -0.867 . . . . 0.66 113.582 176.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.53 122.17 45.74 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.182 0.515 . . . . 1.33 112.129 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.72 148.72 24.62 Favored 'General case' 0 CA--C 1.485 -1.552 0 N-CA-C 107.821 -1.177 . . . . 1.06 107.821 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 46' ' ' MET . 31.1 p -54.75 -33.99 61.96 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 113.556 0.946 . . . . 1.03 113.556 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 tt -66.38 -45.24 80.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.066 -0.716 . . . . 1.56 109.066 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.41 87.49 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.099 -0.501 . . . . 0.43 110.043 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.404 HD21 HG23 ' A' ' 68' ' ' VAL . 55.6 tp -62.9 -39.36 94.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.273 -0.876 . . . . 0.43 111.185 178.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 42' ' ' SER . 65.5 mtm -64.08 -31.27 72.4 Favored 'General case' 0 C--O 1.199 -1.596 0 C-N-CA 120.66 -0.416 . . . . 1.49 110.969 177.199 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.55 -34.28 77.87 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.521 0.677 . . . . 1.88 110.191 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.559 HG21 HD13 ' A' ' 14' ' ' LEU . 35.8 m -64.12 -59.47 4.4 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 106.859 -1.534 . . . . 0.45 106.859 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.31 -38.08 70.78 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.05 -1.432 . . . . 0.27 110.16 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.0 80.84 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.242 0.617 . . . . 0.33 112.533 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -64.45 -36.39 84.0 Favored 'General case' 0 C--O 1.226 -0.171 0 N-CA-C 109.618 -0.512 . . . . 2.84 109.618 179.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.524 HD22 HD11 ' A' ' 5' ' ' LEU . 83.8 mt -64.97 -45.4 85.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.75 -0.659 . . . . 0.9 111.181 176.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 43.9 mt-10 -56.27 -50.53 71.11 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 122.845 0.458 . . . . 0.48 109.881 176.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -61.82 -43.21 99.31 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.68 -1.146 . . . . 1.19 110.095 -177.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.472 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 31.3 ttm180 -65.94 -52.39 50.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.334 -0.394 . . . . 3.07 111.902 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.472 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 85.3 m-85 -92.97 -17.55 23.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.376 1.251 . . . . 1.01 114.376 -170.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.8 53.11 4.71 Favored Glycine 0 C--N 1.312 -0.75 0 C-N-CA 119.99 -1.1 . . . . 0.93 110.762 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.09 140.66 43.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 N-CA-C 108.544 -0.909 . . . . 1.16 108.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 p -93.78 115.13 27.52 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 112.194 0.442 . . . . 1.87 112.194 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.2 mt -104.42 118.05 57.65 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.553 -0.906 . . . . 0.57 108.553 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -57.53 123.35 13.57 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.594 2.196 . . . . 0.87 111.313 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -50.38 -47.82 56.11 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.488 1.115 . . . . 1.83 113.692 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.31 -32.69 70.55 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 120.885 0.374 . . . . 2.34 110.641 -176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.26 -41.11 57.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 108.584 -0.895 . . . . 0.66 108.584 179.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.28 -33.96 68.17 Favored 'General case' 0 C--O 1.214 -0.78 0 C-N-CA 123.712 0.805 . . . . 0.51 111.589 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -90.41 -17.01 54.32 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.434 -0.889 . . . . 0.61 112.76 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -101.57 7.36 42.28 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.587 0.958 . . . . 3.98 113.587 -177.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.404 HG23 HD21 ' A' ' 45' ' ' LEU . 12.7 m -77.3 114.22 17.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 106.904 -1.517 . . . . 0.44 106.904 171.586 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -90.36 -34.69 15.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 121.619 0.723 . . . . 1.91 110.527 -173.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.406 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 67.9 p -117.42 142.52 30.45 Favored Pre-proline 0 N--CA 1.411 -2.423 0 CA-C-N 115.343 -0.844 . . . . 0.47 109.961 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.678 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 76.9 Cg_exo -55.5 -28.9 66.72 Favored 'Trans proline' 0 CA--C 1.499 -1.24 0 C-N-CA 123.866 3.044 . . . . 0.32 111.946 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -50.3 -51.71 42.85 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 124.425 1.078 . . . . 1.48 109.668 174.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -65.67 -42.48 91.26 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 115.101 -0.954 . . . . 2.13 111.249 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.748 HD22 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -66.49 -44.07 83.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.964 -0.754 . . . . 0.9 108.964 -177.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -56.98 -51.86 67.54 Favored 'General case' 0 C--O 1.245 0.854 0 C-N-CA 123.525 0.73 . . . . 0.34 109.226 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.35 -44.07 92.72 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.813 -1.085 . . . . 0.57 111.407 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.7 tp -57.85 -50.06 74.59 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.751 0.82 . . . . 1.96 111.341 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.7 mt -70.55 -40.29 77.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.393 -0.523 . . . . 0.55 110.724 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.432 ' OD1' HD23 ' A' ' 4' ' ' LEU . 13.8 m-80 -60.99 -39.63 90.4 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.48 0.181 . . . . 1.14 110.745 177.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.85 -39.78 64.67 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.314 -0.469 . . . . 0.53 112.445 178.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.65 -45.03 65.91 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.838 0.352 . . . . 0.6 110.936 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 4' ' ' LEU . 21.5 mt -69.36 -15.5 63.33 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.402 0.681 . . . . 1.42 112.486 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.2 73.76 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-O 121.526 0.679 . . . . 0.85 109.182 173.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -93.34 -67.08 0.88 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.432 -0.804 . . . . 2.44 109.605 177.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.06 104.03 4.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.258 -0.883 . . . . 2.12 112.011 -173.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.84 0 N-CA-C 107.113 -1.439 . . . . 3.84 107.113 179.567 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 mmt . . . . . 0 N--CA 1.47 0.568 0 CA-C-O 120.888 0.375 . . . . 6.63 111.128 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.63 25.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.644 0.735 . . . . 4.09 109.69 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.476 HG23 ' CD1' ' A' ' 56' ' ' TYR . 52.0 m -87.8 105.49 17.44 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-O 122.033 0.921 . . . . 2.77 111.865 -177.001 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 28.9 tp 175.25 156.15 0.17 Allowed 'General case' 0 N--CA 1.405 -2.709 0 CA-C-N 113.084 -1.871 . . . . 1.51 106.227 172.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.441 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 85.9 mt -120.14 123.67 43.9 Favored 'General case' 0 N--CA 1.406 -2.665 0 N-CA-C 108.273 -1.01 . . . . 0.8 108.273 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.7 p -98.37 -179.87 4.49 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 106.585 -1.635 . . . . 0.63 106.585 172.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.783 HG21 ' HA ' ' A' ' 29' ' ' ASP . 20.6 m -59.47 -31.93 69.78 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 118.638 0.654 . . . . 0.61 110.505 175.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.24 -46.72 63.89 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.44 -0.578 . . . . 1.65 109.44 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -64.51 -39.54 93.96 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.589 -0.732 . . . . 1.41 109.527 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.554 HD11 HD12 ' A' ' 74' ' ' LEU . 15.0 tp -65.49 -51.38 60.48 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 114.893 -1.048 . . . . 0.48 109.195 -177.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -52.32 -40.65 62.15 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 2.46 111.766 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.535 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 60.6 ttt180 -54.3 -54.52 39.09 Favored 'General case' 0 C--O 1.24 0.577 0 O-C-N 123.549 0.531 . . . . 3.93 110.586 176.321 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.46 -39.13 89.76 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.536 -0.756 . . . . 0.5 111.547 -175.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.8 -50.99 68.84 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.162 0.288 . . . . 1.44 111.174 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.8 t -63.52 -34.72 69.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 CA-C-O 120.999 0.428 . . . . 0.8 111.46 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 95.6 mt-10 -63.22 -49.31 74.68 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.245 0.545 . . . . 2.05 111.218 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 p -82.23 -8.13 59.64 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.473 -0.785 . . . . 1.39 112.889 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.0 -26.85 68.75 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.581 0.705 . . . . 1.58 110.26 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.22 -52.97 4.81 Favored Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 109.749 -1.34 . . . . 2.32 109.749 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -62.06 109.18 1.21 Allowed 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.253 1.021 . . . . 5.17 108.75 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.9 m -113.77 27.39 9.58 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.538 1.161 . . . . 4.86 109.391 -177.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -74.39 -64.09 1.1 Allowed 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.666 -1.605 . . . . 4.5 106.666 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 157.78 67.49 0.01 OUTLIER Glycine 0 N--CA 1.409 -3.11 0 C-N-CA 119.604 -1.284 . . . . 2.77 113.618 176.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 t -79.74 73.01 6.47 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 107.566 -1.272 . . . . 2.87 107.566 170.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -57.89 125.28 22.37 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.027 -0.988 . . . . 3.23 111.434 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -132.87 26.31 4.3 Favored 'General case' 0 C--N 1.282 -2.344 0 N-CA-C 107.059 -1.46 . . . . 1.16 107.059 -171.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.3 p -53.6 134.46 41.23 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 114.401 -1.272 . . . . 1.46 112.799 -174.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.32 -161.52 27.67 Favored Glycine 0 N--CA 1.43 -1.734 0 CA-C-N 114.842 -1.072 . . . . 1.02 110.969 177.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.783 ' HA ' HG21 ' A' ' 7' ' ' THR . 10.2 m-20 -77.7 126.33 30.7 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.064 -0.717 . . . . 2.07 109.064 177.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.411 ' HB2' HD12 ' A' ' 33' ' ' LEU . 23.6 p90 -123.32 19.08 9.8 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.943 -0.762 . . . . 0.44 108.943 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.687 HD13 ' HB3' ' A' ' 72' ' ' ARG . 29.3 mt -53.63 -23.19 10.39 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.58 1.326 . . . . 0.39 114.58 -175.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -92.0 -22.53 19.93 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.894 0.378 . . . . 2.04 110.475 -176.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.411 HD12 ' HB2' ' A' ' 30' ' ' PHE . 66.3 mt -77.59 114.09 16.08 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.824 -1.176 . . . . 1.37 107.824 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -75.72 146.74 39.87 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 120.128 -0.629 . . . . 3.94 109.631 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.568 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.5 m-85 -55.22 -40.88 71.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.993 -0.549 . . . . 0.35 111.424 -175.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.06 -34.78 63.87 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.814 -0.63 . . . . 2.79 111.724 178.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.2 -34.23 32.42 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.143 -0.481 . . . . 0.88 110.259 -174.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 pt -90.8 17.7 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 113.118 0.784 . . . . 0.6 113.118 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.81 14.47 67.47 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 114.564 0.586 . . . . 0.66 114.564 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.568 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 32.6 m-85 -101.33 115.17 29.88 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 120.796 0.331 . . . . 1.33 111.418 -179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -87.22 154.54 20.63 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.427 -1.694 . . . . 1.06 106.427 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.554 ' O ' ' HG3' ' A' ' 46' ' ' MET . 44.1 p -51.44 -27.88 11.46 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 113.509 0.929 . . . . 1.03 113.509 177.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.35 -57.76 8.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.162 -0.681 . . . . 1.56 109.162 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.68 78.25 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.23 0.538 . . . . 0.43 110.391 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 57.8 tp -62.69 -33.6 75.4 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.121 -0.945 . . . . 0.43 110.95 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.554 ' HG3' ' O ' ' A' ' 42' ' ' SER . 69.3 mtm -65.81 -29.76 70.29 Favored 'General case' 0 C--O 1.199 -1.559 0 C-N-CA 120.164 -0.615 . . . . 1.49 112.084 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 36.2 tt0 -65.79 -29.12 69.56 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.803 0.811 . . . . 1.88 109.505 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 24.6 m -64.62 -58.01 7.5 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 106.193 -1.78 . . . . 0.45 106.193 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.33 -38.44 74.11 Favored 'General case' 0 C--O 1.2 -1.523 0 CA-C-N 113.875 -1.512 . . . . 0.27 110.759 176.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.66 -45.31 81.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.531 0.732 . . . . 0.33 112.348 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.522 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 50.6 mtt180 -64.83 -38.63 91.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.744 -0.662 . . . . 2.84 109.572 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 48' ' ' THR . 86.7 mt -65.71 -41.39 92.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.055 -0.975 . . . . 0.9 110.271 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 37.7 mt-10 -57.0 -54.85 42.11 Favored 'General case' 0 CA--C 1.502 -0.885 0 O-C-N 123.624 0.577 . . . . 0.48 109.813 175.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.3 t -62.33 -38.5 89.7 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.501 -0.772 . . . . 1.19 111.928 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -68.1 -51.02 51.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.693 0.627 . . . . 3.07 112.693 177.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.476 ' CD1' HG23 ' A' ' 3' ' ' THR . 65.0 m-85 -93.77 -12.38 29.25 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.749 1.018 . . . . 1.01 113.749 -171.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.63 17.94 79.45 Favored Glycine 0 C--N 1.308 -1.006 0 C-N-CA 120.698 -0.763 . . . . 0.93 111.285 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.474 HG12 ' HB2' ' A' ' 56' ' ' TYR . 7.5 p -98.38 135.06 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 N-CA-C 107.948 -1.13 . . . . 1.16 107.948 -178.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 m -92.87 118.45 31.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.997 -0.742 . . . . 1.87 108.997 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.1 mt -103.29 117.55 59.96 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.548 -0.908 . . . . 0.57 108.548 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.34 128.19 29.1 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.839 2.359 . . . . 0.87 110.977 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -51.28 -38.75 54.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.363 1.065 . . . . 1.83 111.943 -177.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.68 -45.31 79.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.901 -0.591 . . . . 2.34 110.652 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.99 -36.06 56.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 O-C-N 123.428 0.455 . . . . 0.66 109.879 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.48 -32.17 64.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.475 -0.784 . . . . 0.51 111.365 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 42' ' ' SER . . . -116.98 23.13 10.15 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.5 -0.857 . . . . 0.61 112.297 178.097 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -101.15 -22.16 14.76 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.45 0.643 . . . . 3.98 110.334 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.509 HG21 ' HB2' ' A' ' 74' ' ' LEU . 17.8 m -76.19 130.8 35.89 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 CA-C-N 114.984 -1.007 . . . . 0.44 111.594 -175.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.43 -50.09 6.78 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.706 -0.679 . . . . 1.91 111.343 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 32.2 p -109.13 149.23 39.4 Favored Pre-proline 0 N--CA 1.405 -2.701 0 CA-C-N 115.846 -0.615 . . . . 0.47 110.479 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.494 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 89.3 Cg_exo -51.82 -38.81 68.32 Favored 'Trans proline' 0 C--O 1.211 -0.831 0 C-N-CA 123.269 2.646 . . . . 0.32 112.228 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.687 ' HB3' HD13 ' A' ' 31' ' ' LEU . 13.6 ptt180 -55.63 -35.17 65.6 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.676 0.991 . . . . 1.48 113.676 176.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -63.78 -50.62 68.29 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.791 0.805 . . . . 2.13 109.137 176.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.554 HD12 HD11 ' A' ' 10' ' ' LEU . 3.4 tm? -66.57 -47.22 73.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.319 -1.31 . . . . 0.9 109.906 -176.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.415 HD13 HD22 ' A' ' 10' ' ' LEU . 51.4 tp -56.78 -48.77 77.12 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.646 0.778 . . . . 0.34 110.735 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.68 -44.05 82.82 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.346 -0.388 . . . . 0.57 111.52 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.11 -47.94 83.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.004 -0.544 . . . . 1.96 109.565 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.15 -35.21 52.44 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 C-N-CA 120.158 -0.617 . . . . 0.55 111.439 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.1 -44.02 82.8 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 117.969 0.35 . . . . 1.14 110.8 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.18 -43.33 98.77 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.541 -0.624 . . . . 0.53 111.541 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.58 -25.77 65.06 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.974 0.416 . . . . 0.6 111.271 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 66.6 mt -79.58 -40.66 28.9 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 116.207 -0.451 . . . . 1.42 110.513 177.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.89 -34.2 76.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.439 0.638 . . . . 0.85 110.174 177.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -86.04 3.47 42.2 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.457 -0.792 . . . . 2.44 112.277 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.17 90.71 7.91 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.825 0.345 . . . . 2.12 110.709 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.369 0 N-CA-C 107.579 -1.267 . . . . 3.84 107.579 -178.485 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 110.457 -0.201 . . . . 6.63 110.457 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 67.49 34.58 4.6 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 123.966 0.906 . . . . 4.09 111.1 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.1 t -81.34 106.97 13.73 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.305 -1.368 . . . . 2.77 107.305 176.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' A' ' 82' ' ' LEU . 11.5 tp -68.59 154.27 42.21 Favored 'General case' 0 N--CA 1.407 -2.6 0 CA-C-N 113.154 -1.839 . . . . 1.51 112.498 -172.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.428 HD21 ' CZ ' ' A' ' 56' ' ' TYR . 96.4 mt -101.66 131.34 47.94 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 114.419 -1.264 . . . . 0.8 108.941 176.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p -102.22 -176.44 3.12 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.963 -1.495 . . . . 0.63 106.963 170.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.0 m -58.14 -39.7 79.44 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 118.284 0.493 . . . . 0.61 111.371 177.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.84 -42.53 94.84 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.104 0.478 . . . . 1.65 110.05 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -67.89 -41.19 83.14 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.685 -0.689 . . . . 1.41 109.601 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.428 HD11 ' CD1' ' A' ' 74' ' ' LEU . 28.0 tp -64.82 -43.82 91.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.762 -1.108 . . . . 0.48 110.539 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 26' ' ' LEU . 40.3 ttp180 -49.93 -41.74 46.92 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.471 0.708 . . . . 2.46 111.92 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.418 ' HG2' ' OE2' ' A' ' 16' ' ' GLU . 40.6 ttm180 -55.47 -43.76 75.8 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.915 0.76 . . . . 3.93 111.116 -177.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.465 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -63.68 -42.08 98.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.239 -0.437 . . . . 0.5 110.839 -178.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.648 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -64.83 -37.06 86.34 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.358 -0.383 . . . . 1.44 110.519 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.64 -53.31 32.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 N-CA-C 109.937 -0.394 . . . . 0.8 109.937 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.418 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.9 mt-10 -58.97 -40.6 85.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.902 -0.59 . . . . 2.05 112.503 -177.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.9 p -77.01 -15.29 59.67 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.998 -0.681 . . . . 1.39 112.465 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.86 -58.03 3.27 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.845 -0.798 . . . . 1.58 108.845 177.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.59 56.11 23.34 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.627 -0.715 . . . . 2.32 111.906 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -126.19 160.85 29.11 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 109.607 -0.516 . . . . 5.17 109.607 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.3 m -86.11 33.37 0.61 Allowed 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 121.515 0.674 . . . . 4.86 112.277 -172.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -146.69 136.24 22.98 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 121.893 -0.505 . . . . 4.5 109.883 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -93.61 87.95 1.2 Allowed Glycine 0 N--CA 1.418 -2.537 0 N-CA-C 108.5 -1.84 . . . . 2.77 108.5 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.532 HG23 HD13 ' A' ' 26' ' ' LEU . 6.8 t -61.47 179.07 0.25 Allowed 'General case' 0 CA--C 1.573 1.836 0 C-N-CA 123.381 0.672 . . . . 2.87 112.629 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.46 80.3 4.86 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.24 0.83 . . . . 3.23 113.24 -172.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.541 ' O ' ' HD3' ' A' ' 11' ' ' ARG . 9.5 mp -121.45 8.64 10.19 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.432 -1.258 . . . . 1.16 108.038 174.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.2 m -66.57 138.86 57.78 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.19 -1.368 . . . . 1.46 109.986 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.54 -124.16 12.44 Favored Glycine 0 N--CA 1.439 -1.113 0 N-CA-C 110.263 -1.135 . . . . 1.02 110.263 -177.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.766 ' HA ' HG21 ' A' ' 7' ' ' THR . 6.6 p-10 -115.28 122.37 45.75 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 108.591 -0.892 . . . . 2.07 108.591 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.32 19.49 15.51 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.49 0.662 . . . . 0.44 109.518 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.64 ' O ' ' HB ' ' A' ' 70' ' ' THR . 59.5 mt -51.98 -32.08 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 114.716 1.376 . . . . 0.39 114.716 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -94.73 -1.88 52.15 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.101 0.477 . . . . 2.04 112.007 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp -81.34 129.52 34.66 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.722 -0.844 . . . . 1.37 108.722 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 142.61 43.77 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 108.033 -1.099 . . . . 3.94 108.033 -177.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' HA ' HG12 ' A' ' 38' ' ' ILE . 73.2 m-85 -60.13 -41.8 93.45 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 120.546 -0.462 . . . . 0.35 109.8 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.25 -27.02 61.7 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.039 -0.528 . . . . 2.79 112.101 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.19 -34.47 37.39 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.651 -0.87 . . . . 0.88 108.651 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.525 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.8 pt -91.64 16.95 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.049 0.452 . . . . 0.6 110.803 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.84 55.77 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.55 -0.75 . . . . 0.66 113.701 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -118.09 108.93 15.82 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 113.156 0.798 . . . . 1.33 113.156 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.35 147.45 26.52 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 106.924 -1.51 . . . . 1.06 106.924 174.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.521 ' O ' ' HG3' ' A' ' 46' ' ' MET . 18.0 p -50.87 -31.04 16.14 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 114.237 1.199 . . . . 1.03 114.237 -178.333 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.77 -53.94 43.06 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.226 -1.028 . . . . 1.56 108.226 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.51 -35.24 79.83 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.29 0.567 . . . . 0.43 110.32 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 59.8 tp -61.57 -37.71 84.84 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.352 -0.84 . . . . 0.43 111.615 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.521 ' HG3' ' O ' ' A' ' 42' ' ' SER . 59.9 mtm -63.78 -33.4 75.57 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 120.735 -0.386 . . . . 1.49 110.657 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -66.78 -32.18 73.3 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 121.946 0.879 . . . . 1.88 109.805 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.648 HG21 HD13 ' A' ' 14' ' ' LEU . 55.6 m -66.52 -55.86 13.57 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.411 -1.329 . . . . 0.45 107.411 178.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.511 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -55.92 -38.21 69.97 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.72 -1.582 . . . . 0.27 109.855 177.373 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.85 80.26 Favored 'General case' 0 C--O 1.251 1.17 0 C-N-CA 123.099 0.56 . . . . 0.33 112.45 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 -66.31 -38.72 88.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.967 -0.561 . . . . 2.84 109.724 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 13' ' ' ALA . 85.4 mt -63.98 -45.68 87.98 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.422 -0.808 . . . . 0.9 110.498 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.8 mt-10 -56.53 -49.6 74.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.83 -0.623 . . . . 0.48 110.084 176.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.2 t -62.37 -54.73 36.17 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.983 -1.008 . . . . 1.19 110.894 -177.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.91 -38.13 89.94 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.375 0.879 . . . . 3.07 113.375 -174.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.428 ' CZ ' HD21 ' A' ' 5' ' ' LEU . 99.4 m-85 -98.7 -9.52 24.5 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 114.504 1.298 . . . . 1.01 114.504 -173.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.42 50.58 8.11 Favored Glycine 0 C--N 1.316 -0.557 0 C-N-CA 120.278 -0.963 . . . . 0.93 111.792 178.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.3 p -142.61 175.48 4.42 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 N-CA-C 106.96 -1.496 . . . . 1.16 106.96 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.6 t -142.22 139.34 31.97 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 119.19 0.905 . . . . 1.87 109.802 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.511 HD12 ' HB1' ' A' ' 49' ' ' ALA . 70.5 mt -114.1 129.46 24.79 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 108.043 -1.095 . . . . 0.57 108.043 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.73 113.98 2.21 Favored 'Trans proline' 0 C--O 1.245 0.844 0 C-N-CA 122.005 1.803 . . . . 0.87 109.742 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -55.49 -29.72 59.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.612 0.765 . . . . 1.83 113.004 -176.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -68.63 -41.03 80.02 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.823 -0.436 . . . . 2.34 109.823 178.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.2 t -75.17 -34.79 32.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.163 -0.68 . . . . 0.66 109.163 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.08 65.54 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.694 -0.685 . . . . 0.51 110.99 176.147 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -91.8 -3.74 68.1 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.591 -0.814 . . . . 0.61 112.76 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -101.37 -14.45 17.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.333 0.587 . . . . 3.98 110.829 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.4 m -76.17 124.25 33.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 CA-C-O 121.047 0.451 . . . . 0.44 109.904 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -92.29 -33.18 14.73 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 115.915 -0.584 . . . . 1.91 111.712 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.64 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 40.2 p -125.63 152.25 71.75 Favored Pre-proline 0 N--CA 1.418 -2.037 0 CA-C-N 115.645 -0.707 . . . . 0.47 110.085 -177.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.588 ' HB2' HD23 ' A' ' 31' ' ' LEU . 54.2 Cg_exo -56.37 -26.3 61.73 Favored 'Trans proline' 0 C--O 1.2 -1.409 0 C-N-CA 123.57 2.846 . . . . 0.32 111.109 176.59 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -51.22 -57.21 9.4 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.84 0.856 . . . . 1.48 109.961 174.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -64.32 -41.11 96.99 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.463 -0.789 . . . . 2.13 110.885 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.428 ' CD1' HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -67.54 -46.17 73.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.47 -0.786 . . . . 0.9 110.691 -177.396 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.6 tp -57.6 -52.16 66.56 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.007 -0.738 . . . . 0.34 109.007 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -52.39 -44.6 65.43 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.811 1.244 . . . . 0.57 111.414 177.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 67.9 tp -62.38 -51.3 68.11 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.732 0.813 . . . . 1.96 111.197 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 74' ' ' LEU . 58.8 mt -66.33 -39.75 84.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.165 -0.47 . . . . 0.55 110.119 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.95 -43.8 86.58 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.411 -0.359 . . . . 1.14 110.121 176.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.468 ' O ' ' HG3' ' A' ' 84' ' ' GLU . . . -64.23 -42.7 97.8 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.575 -0.739 . . . . 0.53 112.003 178.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.84 79.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.757 0.313 . . . . 0.6 110.746 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 4' ' ' LEU . 71.0 mt -65.58 -36.65 84.39 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.647 0.379 . . . . 1.42 110.978 176.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.83 -34.65 78.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.069 -0.514 . . . . 0.85 110.6 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 80' ' ' GLY . 42.1 mt-10 -75.39 -32.79 60.89 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.299 -0.41 . . . . 2.44 110.499 178.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 106.52 1.91 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.308 0.575 . . . . 2.12 110.982 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.439 0 CA-C-N 115.306 -0.861 . . . . 3.84 108.821 178.84 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.6 tp . . . . . 0 N--CA 1.389 -3.509 0 N-CA-C 108.636 -0.876 . . . . 1.51 108.636 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.5 HD21 ' CE2' ' A' ' 56' ' ' TYR . 88.7 mt -116.19 130.91 57.02 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 108.193 -1.04 . . . . 0.8 108.193 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.3 p -102.02 -174.82 2.67 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 108.017 -1.105 . . . . 0.63 108.017 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.912 HG21 ' HA ' ' A' ' 29' ' ' ASP . 12.0 m -57.01 -45.71 82.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.02 0.438 . . . . 0.61 110.278 178.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 18.0 t70 -57.22 -45.17 84.12 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.861 0.864 . . . . 1.65 111.298 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 5' ' ' LEU . 15.4 m-20 -67.1 -39.66 86.75 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.367 0.603 . . . . 1.41 110.102 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.4 HD11 ' CD1' ' A' ' 74' ' ' LEU . 9.8 tp -65.94 -42.46 90.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.099 -0.955 . . . . 0.48 109.04 -177.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.476 ' O ' HG23 ' A' ' 15' ' ' VAL . 39.0 ttm180 -53.02 -48.74 67.33 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.135 -0.939 . . . . 2.46 109.518 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.557 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 48.3 mtt180 -54.03 -44.53 71.06 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.016 -0.993 . . . . 3.93 111.648 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.93 91.7 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.53 0.519 . . . . 0.5 110.719 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.42 HD12 HG21 ' A' ' 48' ' ' THR . 9.4 mp -67.3 -31.64 72.07 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.998 0.37 . . . . 1.44 111.998 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 11' ' ' ARG . 95.6 t -64.75 -48.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 N-CA-C 108.581 -0.896 . . . . 0.8 108.581 175.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 47.0 mt-10 -58.14 -48.03 81.49 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.623 -0.717 . . . . 2.05 110.991 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.9 p . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.305 0.854 . . . . 1.39 113.305 -177.998 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.912 ' HA ' HG21 ' A' ' 7' ' ' THR . 5.2 m-20 . . . . . 0 CA--C 1.483 -1.609 0 N-CA-C 109.521 -0.548 . . . . 2.07 109.521 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' HD13 ' A' ' 33' ' ' LEU . 18.7 p90 -109.0 14.13 24.24 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.093 -0.706 . . . . 0.44 109.093 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.776 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 67.2 mt -53.54 -26.85 22.91 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 113.608 0.966 . . . . 0.39 113.608 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -95.11 -11.01 29.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.3 -0.409 . . . . 2.04 111.274 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.5 mp -82.05 116.25 21.56 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.659 -0.867 . . . . 1.37 108.659 175.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -75.7 149.89 37.99 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 115.287 -0.87 . . . . 3.94 110.426 -173.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.485 ' HA ' HG12 ' A' ' 38' ' ' ILE . 56.7 m-85 -61.96 -39.84 93.52 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.423 -0.353 . . . . 0.35 111.097 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -58.01 -31.99 67.49 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.401 0.619 . . . . 2.79 111.137 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -82.37 -26.01 33.29 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.349 -0.841 . . . . 0.88 111.246 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.485 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.3 pt -98.07 14.42 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.097 0.475 . . . . 0.6 111.245 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.39 40.96 99.73 Favored Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.767 -0.651 . . . . 0.66 113.116 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.447 ' HB2' HG13 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -115.97 113.96 23.97 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.482 -0.562 . . . . 1.33 109.482 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -85.83 156.94 20.35 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.338 -0.616 . . . . 1.06 109.338 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 46' ' ' MET . 24.4 p -53.39 -33.75 54.99 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.108 0.781 . . . . 1.03 113.108 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.3 -49.13 70.66 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.927 -0.768 . . . . 1.56 108.927 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.51 96.62 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 109.605 -0.517 . . . . 0.43 109.605 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 68' ' ' VAL . 63.8 tp -60.62 -41.65 95.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.995 -1.002 . . . . 0.43 111.223 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.8 mtp -61.68 -40.58 95.47 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-N 116.609 -0.269 . . . . 1.49 110.344 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 34.5 tt0 -65.42 -34.86 79.29 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.471 0.653 . . . . 1.88 110.511 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.42 HG21 HD12 ' A' ' 14' ' ' LEU . 60.1 m -64.03 -56.74 12.88 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 107.252 -1.388 . . . . 0.45 107.252 178.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.55 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.0 -36.27 70.21 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 113.923 -1.489 . . . . 0.27 109.995 176.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.512 ' HA ' ' OE1' ' A' ' 53' ' ' GLU . . . -58.68 -40.99 85.16 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.466 0.706 . . . . 0.33 112.414 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 62.6 mtp85 -63.35 -42.32 98.9 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.376 -0.972 . . . . 2.84 108.376 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.32 -41.75 89.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.389 -1.278 . . . . 0.9 111.185 178.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.512 ' OE1' ' HA ' ' A' ' 50' ' ' ALA . 50.2 mt-10 -55.81 -53.2 59.57 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 123.262 0.625 . . . . 0.48 109.836 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.8 m -62.49 -46.62 87.61 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 114.938 -1.028 . . . . 1.19 111.357 -178.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -65.46 -45.78 82.43 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.7 -0.682 . . . . 3.07 112.373 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.5 ' CE2' HD21 ' A' ' 5' ' ' LEU . 94.0 m-85 -97.19 6.37 48.55 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.179 0.807 . . . . 1.01 113.179 -175.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.29 52.72 49.82 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 115.984 -0.553 . . . . 0.93 112.188 177.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.526 HG11 HD12 ' A' ' 82' ' ' LEU . 28.6 m -132.86 176.52 8.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.665 -0.494 . . . . 1.16 109.665 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 t -141.9 129.62 21.62 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.95 -1.13 . . . . 1.87 107.95 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.55 HD12 ' HB1' ' A' ' 49' ' ' ALA . 92.9 mt -106.93 124.19 36.16 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.926 -0.579 . . . . 0.57 109.513 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 126.5 21.73 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.048 2.499 . . . . 0.87 111.719 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -52.99 -30.75 36.99 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.809 1.244 . . . . 1.83 113.43 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 11.4 t70 -69.82 -47.65 61.99 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.276 -0.639 . . . . 2.34 109.276 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -72.4 -33.25 45.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.495 -0.775 . . . . 0.66 110.618 -174.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.69 -27.42 62.89 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.862 -0.608 . . . . 0.51 111.443 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.85 19.43 8.91 Favored Glycine 0 N--CA 1.434 -1.455 0 N-CA-C 111.06 -0.816 . . . . 0.61 111.06 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 14.5 tpp180 -100.9 -19.27 15.98 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.254 -0.647 . . . . 3.98 109.254 -178.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.461 HG23 HD21 ' A' ' 45' ' ' LEU . 30.2 m -79.05 123.7 36.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-N 115.04 -0.982 . . . . 0.44 111.615 -177.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -91.71 -31.78 15.68 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.279 -0.873 . . . . 1.91 110.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 21.5 p -125.22 145.25 50.02 Favored Pre-proline 0 N--CA 1.418 -2.034 0 CA-C-N 115.337 -0.847 . . . . 0.47 110.395 -176.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.776 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 77.1 Cg_exo -54.03 -32.1 67.24 Favored 'Trans proline' 0 C--O 1.215 -0.648 0 C-N-CA 123.732 2.954 . . . . 0.32 113.192 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -52.9 -43.38 66.14 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.222 0.326 . . . . 1.48 111.774 176.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -64.55 -48.05 76.51 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.595 0.758 . . . . 2.13 109.978 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.458 ' HB2' HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -66.4 -42.09 88.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.925 -1.034 . . . . 0.9 110.114 -176.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.07 -52.31 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.552 -0.536 . . . . 0.34 109.552 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.7 -43.32 94.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.5 -0.773 . . . . 0.57 111.763 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.61 -46.9 87.58 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 109.781 -0.451 . . . . 1.96 109.781 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.79 -35.42 55.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 C-N-CA 120.944 -0.302 . . . . 0.55 110.583 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -40.79 89.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 120.689 0.28 . . . . 1.14 110.47 175.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.01 -32.43 69.6 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.776 -0.647 . . . . 0.53 112.449 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.12 60.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.819 0.819 . . . . 0.6 109.641 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.526 HD12 HG11 ' A' ' 58' ' ' VAL . 8.5 mp -72.62 -6.7 46.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.075 -0.966 . . . . 1.42 111.724 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.549 0.69 . . . . 0.85 109.904 170.598 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.1 tp . . . . . 0 N--CA 1.418 -2.074 0 CA-C-O 121.485 0.66 . . . . 1.51 110.714 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.532 HD11 HD12 ' A' ' 52' ' ' LEU . 73.8 mt -98.9 133.27 43.42 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.604 -0.726 . . . . 0.8 110.024 -178.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 p -99.92 -176.6 3.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.457 -1.312 . . . . 0.63 107.457 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.675 HG21 ' HA ' ' A' ' 29' ' ' ASP . 16.7 m -57.64 -38.86 75.76 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.11 -0.7 . . . . 0.61 109.11 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -60.03 -47.43 85.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.781 -1.1 . . . . 1.65 111.272 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.22 -39.76 89.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.835 -0.621 . . . . 1.41 110.098 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 17.3 tp -65.08 -45.05 86.85 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.943 -1.026 . . . . 0.48 109.265 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 11' ' ' ARG . 36.8 ttm180 -50.75 -54.56 22.35 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 124.0 0.92 . . . . 2.46 109.914 177.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 23.3 ttp180 -56.05 -46.33 78.94 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.67 -1.15 . . . . 3.93 111.689 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.535 ' HB1' HD21 ' A' ' 52' ' ' LEU . . . -62.16 -40.65 96.7 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.367 0.417 . . . . 0.5 111.281 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.12 -38.65 91.82 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.634 0.254 . . . . 1.44 111.34 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 11' ' ' ARG . 89.3 t -66.71 -47.59 82.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.857 -0.423 . . . . 0.8 109.857 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 45.9 mt-10 -59.37 -39.69 84.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.289 -0.414 . . . . 2.05 111.021 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.573 ' CB ' ' HA ' ' A' ' 48' ' ' THR . 20.6 m . . . . . 0 C--N 1.309 -1.16 0 CA-C-O 121.302 0.573 . . . . 1.39 112.114 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.675 ' HA ' HG21 ' A' ' 7' ' ' THR . 19.9 t70 . . . . . 0 N--CA 1.437 -1.116 0 N-CA-C 108.609 -0.885 . . . . 2.07 108.609 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.442 ' HB2' HD12 ' A' ' 33' ' ' LEU . 25.1 p90 -101.32 14.92 30.47 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.431 -0.35 . . . . 0.44 111.624 -175.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.72 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 41.0 mt -52.75 -25.62 11.72 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.919 1.451 . . . . 0.39 114.919 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -92.19 -16.94 25.56 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.945 0.402 . . . . 2.04 111.315 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 30' ' ' PHE . 81.2 mt -77.53 114.78 16.72 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 121.308 0.575 . . . . 1.37 109.735 -176.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HG2' HG22 ' A' ' 70' ' ' THR . 46.1 mtp180 -72.64 141.01 48.31 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.19 -0.914 . . . . 3.94 109.903 -172.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 38.9 m-85 -60.69 -39.35 88.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.501 -0.318 . . . . 0.35 110.258 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -56.7 -31.78 64.83 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.517 0.727 . . . . 2.79 111.142 177.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -82.65 -34.34 27.52 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.087 -0.506 . . . . 0.88 110.91 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.468 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.1 pt -90.79 9.71 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 112.511 0.56 . . . . 0.6 112.511 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.51 29.88 31.63 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.639 -0.709 . . . . 0.66 114.401 174.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 8.6 m-85 -111.59 121.46 45.21 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 117.25 0.525 . . . . 1.33 111.271 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -84.65 152.62 23.66 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 107.093 -1.447 . . . . 1.06 107.093 173.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.443 ' O ' ' HG3' ' A' ' 46' ' ' MET . 13.5 p -54.27 -30.44 50.57 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.914 0.709 . . . . 1.03 112.914 176.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.33 -52.37 54.32 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.08 -0.711 . . . . 1.56 109.08 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.26 -33.04 74.63 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.372 0.606 . . . . 0.43 110.247 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.543 HD21 HG23 ' A' ' 68' ' ' VAL . 44.8 tp -63.48 -46.73 84.81 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.51 -0.768 . . . . 0.43 110.199 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.549 ' HG2' ' HB1' ' A' ' 65' ' ' ALA . 70.8 mtm -63.92 -33.95 76.87 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.392 -0.367 . . . . 1.49 111.129 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.9 -33.48 75.41 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 121.957 0.884 . . . . 1.88 109.032 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.573 ' HA ' ' CB ' ' A' ' 17' ' ' SER . 86.5 m -68.99 -62.21 1.47 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.747 -1.115 . . . . 0.45 108.845 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.456 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.77 -25.32 54.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.912 -1.04 . . . . 0.27 111.575 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -43.65 84.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 123.288 0.635 . . . . 0.33 110.668 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -66.38 -37.41 85.21 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.108 -0.951 . . . . 2.84 110.769 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.535 HD21 ' HB1' ' A' ' 13' ' ' ALA . 3.9 mm? -62.66 -43.7 98.14 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 122.315 0.246 . . . . 0.9 110.431 177.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 59' ' ' SER . 43.1 mt-10 -58.0 -48.15 80.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 123.67 0.606 . . . . 0.48 110.638 175.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 m -63.4 -53.96 44.25 Favored 'General case' 0 CA--C 1.559 1.29 0 CA-C-O 121.196 0.522 . . . . 1.19 112.282 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -62.3 -38.04 87.87 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.948 0.899 . . . . 3.07 112.938 -174.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -102.29 -1.24 31.49 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 114.098 1.148 . . . . 1.01 114.098 -177.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.79 52.14 52.58 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 111.195 -0.762 . . . . 0.93 111.195 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.56 HG22 ' H ' ' A' ' 59' ' ' SER . 7.4 p -136.18 178.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 108.287 -1.005 . . . . 1.16 108.287 -174.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.56 ' H ' HG22 ' A' ' 58' ' ' VAL . 7.0 p -138.59 137.33 36.87 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-O 121.032 0.444 . . . . 1.87 109.977 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.456 HD12 ' HB1' ' A' ' 49' ' ' ALA . 87.2 mt -113.53 132.74 22.39 Favored Pre-proline 0 C--N 1.293 -1.881 0 N-CA-C 108.628 -0.878 . . . . 0.57 108.628 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -61.71 123.36 12.53 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 122.196 1.93 . . . . 0.87 111.012 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -53.42 -31.74 46.6 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.315 1.046 . . . . 1.83 111.018 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.66 -49.16 69.63 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.853 -1.067 . . . . 2.34 111.04 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.691 HG11 ' HG ' ' A' ' 77' ' ' LEU . 40.9 t -72.88 -33.81 44.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 109.805 -0.443 . . . . 0.66 109.805 -176.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.549 ' HB1' ' HG2' ' A' ' 46' ' ' MET . . . -58.05 -24.43 58.35 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.979 0.733 . . . . 0.51 112.979 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.63 2.81 34.25 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.495 -0.86 . . . . 0.61 112.364 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -108.1 -9.54 15.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.298 0.481 . . . . 3.98 112.298 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.543 HG23 HD21 ' A' ' 45' ' ' LEU . 15.5 m -79.35 111.42 16.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 121.465 0.65 . . . . 0.44 111.448 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -91.87 -31.93 15.5 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-N 115.667 -0.697 . . . . 1.91 110.219 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.423 HG22 ' HG2' ' A' ' 34' ' ' ARG . 41.1 p -121.69 145.31 42.76 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 115.325 -0.852 . . . . 0.47 111.016 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.72 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 56.8 Cg_exo -55.83 -34.17 90.57 Favored 'Trans proline' 0 C--O 1.212 -0.78 0 C-N-CA 123.916 3.078 . . . . 0.32 113.214 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 3.5 ptp180 -51.8 -45.86 64.02 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.346 0.403 . . . . 1.48 111.804 176.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -64.54 -44.83 89.56 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.532 0.682 . . . . 2.13 110.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.84 -47.65 68.39 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.952 -1.022 . . . . 0.9 110.657 -177.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 40.8 tp -58.48 -51.77 68.45 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.635 0.374 . . . . 0.34 110.95 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -58.71 -38.54 78.53 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.324 0.39 . . . . 0.57 110.93 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.691 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -62.49 -49.81 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.444 -0.576 . . . . 1.96 109.444 178.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.6 mt -67.34 -36.87 77.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.455 -0.339 . . . . 0.55 110.248 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -61.79 -37.06 82.96 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.873 -0.418 . . . . 1.14 109.873 176.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.51 -37.13 78.15 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.68 -0.691 . . . . 0.53 111.944 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.19 -44.86 67.83 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.189 0.519 . . . . 0.6 109.957 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.8 mt -66.96 -20.55 65.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 1.42 111.692 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.774 0 C-N-CA 122.979 0.511 . . . . 0.85 110.898 177.329 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 29.8 tp . . . . . 0 N--CA 1.388 -3.55 0 N-CA-C 103.937 -2.616 . . . . 1.51 103.937 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.434 ' HG ' HD11 ' A' ' 82' ' ' LEU . 92.1 mt -89.53 123.05 33.28 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 108.82 -0.807 . . . . 0.8 108.82 178.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.7 p -101.87 -173.91 2.46 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 107.313 -1.365 . . . . 0.63 107.313 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.501 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.6 m -57.23 -42.47 81.45 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.153 -0.684 . . . . 0.61 109.153 173.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.28 -48.91 79.85 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.424 1.089 . . . . 1.65 110.821 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -68.79 -39.54 80.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 116.027 -0.533 . . . . 1.41 111.421 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.434 HD22 HD13 ' A' ' 75' ' ' LEU . 18.6 tp -67.01 -45.2 78.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.795 -0.638 . . . . 0.48 109.978 -177.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.484 ' O ' HG23 ' A' ' 15' ' ' VAL . 43.8 ttp-105 -53.81 -45.78 70.91 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.559 -0.746 . . . . 2.46 109.882 177.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.545 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 66.9 mtp180 -55.84 -43.82 77.4 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.058 -0.974 . . . . 3.93 112.11 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.408 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -61.18 -45.43 94.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 123.73 0.644 . . . . 0.5 110.217 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 mp -65.52 -30.8 71.6 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.245 0.461 . . . . 1.44 112.245 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 11' ' ' ARG . 48.2 t -72.83 -34.69 47.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.156 -0.683 . . . . 0.8 109.156 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 44.2 mt-10 -66.19 -42.04 89.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.455 -0.338 . . . . 2.05 111.493 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.555 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 4.7 p . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 113.896 1.073 . . . . 1.39 113.896 -177.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.501 ' HA ' HG21 ' A' ' 7' ' ' THR . 3.8 m-20 . . . . . 0 CA--C 1.495 -1.144 0 N-CA-C 108.32 -0.993 . . . . 2.07 108.32 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 14.9 p90 -128.86 11.81 6.15 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.734 -0.786 . . . . 0.44 111.348 -177.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.851 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 44.8 mt -53.02 -29.13 27.7 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.735 1.383 . . . . 0.39 114.735 -176.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -98.73 -6.08 30.18 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.964 0.411 . . . . 2.04 111.842 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.7 mp -82.33 124.51 30.05 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.807 -0.812 . . . . 1.37 108.807 178.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -76.04 143.58 41.32 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 116.47 -0.332 . . . . 3.94 110.855 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.443 ' HA ' HG12 ' A' ' 38' ' ' ILE . 77.2 m-85 -63.68 -44.1 94.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.463 -0.335 . . . . 0.35 111.014 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -57.95 -26.23 61.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.085 0.469 . . . . 2.79 111.75 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.46 -30.45 27.22 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.168 -0.469 . . . . 0.88 110.681 -176.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.443 HG12 ' HA ' ' A' ' 35' ' ' PHE . 33.9 pt -92.32 19.05 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 121.122 0.487 . . . . 0.6 112.06 -176.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.41 34.3 54.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.047 -0.597 . . . . 0.66 112.011 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -116.19 118.71 33.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 121.467 0.651 . . . . 1.33 112.162 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -85.82 151.14 24.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 106.939 -1.504 . . . . 1.06 106.939 172.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.401 ' O ' ' HG3' ' A' ' 46' ' ' MET . 32.7 p -55.0 -32.27 61.66 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.342 0.497 . . . . 1.03 112.342 176.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 tt -63.92 -50.08 70.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.659 -0.867 . . . . 1.56 108.659 176.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.56 -38.81 88.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.901 -0.59 . . . . 0.43 109.789 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.539 HD21 HG23 ' A' ' 68' ' ' VAL . 57.7 tp -61.72 -46.41 89.77 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.329 -0.851 . . . . 0.43 110.334 177.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.401 ' HG3' ' O ' ' A' ' 42' ' ' SER . 73.1 mtm -62.56 -37.39 85.97 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 116.456 -0.338 . . . . 1.49 111.278 177.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 29.8 tt0 -63.83 -35.47 80.74 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.539 0.685 . . . . 1.88 110.285 176.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.8 m -65.6 -53.25 44.35 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.227 -1.397 . . . . 0.45 107.227 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.439 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.83 -38.63 72.89 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.19 -1.368 . . . . 0.27 110.033 175.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.92 -44.99 91.43 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 123.96 0.904 . . . . 0.33 112.061 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 53.2 mtt180 -62.68 -38.78 91.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.701 -0.851 . . . . 2.84 108.701 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 13' ' ' ALA . 96.6 mt -65.87 -41.18 91.92 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.041 -0.981 . . . . 0.9 111.212 177.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -55.7 -55.32 33.54 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.086 -0.709 . . . . 0.48 109.086 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.8 m -62.42 -51.24 68.31 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.534 -1.212 . . . . 1.19 112.433 -177.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -65.77 -38.09 88.11 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.037 0.754 . . . . 3.07 113.037 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -100.29 3.63 43.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 114.121 1.156 . . . . 1.01 114.121 -175.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.27 52.16 51.5 Favored Glycine 0 N--CA 1.459 0.193 0 N-CA-C 111.501 -0.64 . . . . 0.93 111.501 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.462 HG22 ' H ' ' A' ' 59' ' ' SER . 8.6 p -141.57 177.41 3.43 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 N-CA-C 107.853 -1.165 . . . . 1.16 107.853 -176.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.462 ' H ' HG22 ' A' ' 58' ' ' VAL . 10.8 t -141.55 155.61 45.77 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 119.271 0.942 . . . . 1.87 108.819 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.439 HD12 ' HB1' ' A' ' 49' ' ' ALA . 73.4 mt -135.35 125.76 16.94 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 109.054 -0.721 . . . . 0.57 109.054 -176.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.13 124.84 16.85 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.115 2.543 . . . . 0.87 112.09 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.567 1.321 . . . . 1.83 114.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.578 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 15.3 t70 -71.03 -34.77 71.62 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.007 -0.677 . . . . 2.34 110.664 -176.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.39 -35.17 56.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.603 -0.888 . . . . 0.66 108.603 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -24.7 63.62 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.173 -0.921 . . . . 0.51 110.938 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.4 1.67 55.99 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.093 -0.575 . . . . 0.61 112.463 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 34.6 mmt180 -97.16 -17.58 19.81 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 122.243 -0.563 . . . . 3.98 110.3 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.539 HG23 HD21 ' A' ' 45' ' ' LEU . 30.6 m -76.43 109.94 11.16 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-O 122.045 0.926 . . . . 0.44 109.749 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -93.4 -30.83 14.89 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-N 115.033 -0.985 . . . . 1.91 109.224 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 32.9 p -118.76 136.0 23.99 Favored Pre-proline 0 N--CA 1.402 -2.841 0 CA-C-N 114.315 -1.311 . . . . 0.47 110.15 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.851 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 85.5 Cg_exo -50.58 -30.74 29.19 Favored 'Trans proline' 0 CA--C 1.51 -0.703 0 C-N-CA 124.218 3.279 . . . . 0.32 114.084 -178.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -51.72 -44.86 63.38 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 123.313 0.383 . . . . 1.48 110.891 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -67.89 -45.47 74.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 124.403 1.081 . . . . 2.13 110.03 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.515 HD23 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -66.62 -44.15 82.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.829 -1.078 . . . . 0.9 109.864 -176.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.434 HD13 HD22 ' A' ' 10' ' ' LEU . 42.8 tp -57.14 -52.64 64.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.309 -0.626 . . . . 0.34 109.309 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.27 -44.68 75.85 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.14 0.976 . . . . 0.57 111.706 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.47 -52.05 67.26 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 115.028 -0.987 . . . . 1.96 110.219 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 52.1 mt -69.4 -39.25 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.774 -0.648 . . . . 0.55 110.282 -178.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -55.98 -46.31 78.68 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.32 0.248 . . . . 1.14 111.122 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.02 -43.85 96.64 Favored Glycine 0 N--CA 1.445 -0.762 0 O-C-N 123.832 0.707 . . . . 0.53 111.545 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.78 -38.21 73.4 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 122.652 0.381 . . . . 0.6 111.565 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.434 HD11 ' HG ' ' A' ' 5' ' ' LEU . 68.5 mt -66.55 -35.14 79.51 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 122.452 0.301 . . . . 1.42 111.794 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.745 0 CA-C-N 115.707 -0.679 . . . . 0.85 111.065 178.2 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.1 tp . . . . . 0 N--CA 1.396 -3.134 0 CA-C-O 121.383 0.611 . . . . 1.51 111.126 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.74 HD21 HD22 ' A' ' 52' ' ' LEU . 68.9 mt -91.57 124.28 35.61 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 124.025 0.93 . . . . 0.8 111.317 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.4 p -97.52 -177.81 3.93 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.276 -1.379 . . . . 0.63 107.276 170.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.69 HG21 ' HA ' ' A' ' 29' ' ' ASP . 8.5 m -58.19 -41.72 84.57 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 109.209 -0.663 . . . . 0.61 109.209 174.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -65.44 -43.04 91.68 Favored 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 115.609 -0.723 . . . . 1.65 112.071 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.413 ' HB3' HD23 ' A' ' 5' ' ' LEU . 12.3 m-20 -64.91 -39.65 93.85 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.577 -0.527 . . . . 1.41 109.577 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.593 HD11 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -65.4 -56.26 13.54 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 114.785 -1.098 . . . . 0.48 109.424 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -49.18 -47.97 45.5 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.693 1.197 . . . . 2.46 111.18 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -56.65 -46.16 81.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.853 -1.067 . . . . 3.93 111.154 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.67 77.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.466 -0.788 . . . . 0.5 111.736 -176.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.412 HD13 HG21 ' A' ' 48' ' ' THR . 4.0 mm? -63.74 -57.16 10.82 Favored 'General case' 0 C--O 1.246 0.895 0 N-CA-C 109.298 -0.63 . . . . 1.44 109.298 175.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -54.48 -50.34 58.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-N 114.916 -1.038 . . . . 0.8 111.317 -175.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -61.05 -30.07 70.11 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.268 0.47 . . . . 2.05 112.268 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 C--N 1.318 -0.799 0 CA-C-O 121.041 0.448 . . . . 1.39 112.065 -177.718 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.69 ' HA ' HG21 ' A' ' 7' ' ' THR . 8.4 m-20 . . . . . 0 CA--C 1.489 -1.398 0 N-CA-C 108.73 -0.841 . . . . 2.07 108.73 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -94.34 18.94 10.21 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.373 -0.831 . . . . 0.44 111.436 -174.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.718 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 63.4 mt -53.7 -24.93 16.2 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.197 1.184 . . . . 0.39 114.197 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.18 -19.56 19.96 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.22 0.533 . . . . 2.04 110.812 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.8 mt -80.36 128.34 33.44 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.715 -0.675 . . . . 1.37 109.887 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.72 155.37 35.69 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.126 -0.488 . . . . 3.94 109.996 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -67.1 -44.14 80.75 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 120.872 -0.331 . . . . 0.35 110.432 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.2 -24.64 64.97 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.6 0.714 . . . . 2.79 110.533 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.78 -30.73 40.76 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.462 -0.79 . . . . 0.88 110.057 -177.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.5 pt -98.33 13.11 4.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 112.126 0.417 . . . . 0.6 112.126 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.02 48.96 18.22 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 115.881 -0.599 . . . . 0.66 112.91 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -134.37 118.33 17.33 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.699 0.629 . . . . 1.33 112.699 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -91.04 161.52 15.09 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.073 -0.512 . . . . 1.06 109.888 172.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.496 ' O ' ' HG3' ' A' ' 46' ' ' MET . 56.0 p -54.98 -29.44 56.99 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.476 1.287 . . . . 1.03 114.476 -179.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.11 -50.82 64.58 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 117.991 0.36 . . . . 1.56 110.424 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.98 86.71 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.68 0.752 . . . . 0.43 109.637 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.659 ' O ' ' HB ' ' A' ' 48' ' ' THR . 29.8 tp -63.87 -40.63 97.0 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.706 -1.134 . . . . 0.43 110.989 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.5 mtm -64.58 -37.06 86.26 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 121.774 -0.579 . . . . 1.49 112.02 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.73 -28.58 68.54 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.103 0.954 . . . . 1.88 109.829 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.659 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 62.5 m -64.89 -53.84 40.18 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.57 -1.641 . . . . 0.45 106.57 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.496 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -56.49 -36.21 68.87 Favored 'General case' 0 C--O 1.205 -1.287 0 CA-C-N 114.341 -1.299 . . . . 0.27 110.041 174.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.77 -40.76 80.53 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 122.917 0.487 . . . . 0.33 112.032 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.1 mtp85 -64.79 -39.3 93.37 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.654 0.74 . . . . 2.84 109.159 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.74 HD22 HD21 ' A' ' 5' ' ' LEU . 64.4 mt -65.27 -44.67 87.28 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.429 -1.26 . . . . 0.9 109.413 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 42.8 mt-10 -55.97 -50.55 70.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.541 -0.754 . . . . 0.48 110.227 176.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.1 m -62.99 -49.55 74.26 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.659 -0.701 . . . . 1.19 112.025 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -63.68 -44.06 94.83 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.446 0.536 . . . . 3.07 112.446 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -94.65 -7.45 40.8 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.08 0.77 . . . . 1.01 113.08 -173.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 69.39 51.54 26.25 Favored Glycine 0 C--O 1.24 0.483 0 N-CA-C 111.298 -0.721 . . . . 0.93 111.298 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 59' ' ' SER . 11.0 p -141.3 176.86 4.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 N-CA-C 107.62 -1.252 . . . . 1.16 107.62 -176.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.416 ' H ' HG22 ' A' ' 58' ' ' VAL . 17.7 t -139.06 132.23 29.78 Favored 'General case' 0 N--CA 1.424 -1.755 0 N-CA-C 108.433 -0.951 . . . . 1.87 108.433 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' HB1' ' A' ' 49' ' ' ALA . 67.0 mt -104.59 123.14 41.25 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.003 -0.999 . . . . 0.57 108.933 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.532 ' HB2' HG23 ' A' ' 64' ' ' VAL . 36.9 Cg_exo -58.79 118.28 5.14 Favored 'Trans proline' 0 C--O 1.25 1.11 0 C-N-CA 122.373 2.049 . . . . 0.87 110.413 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.92 -26.87 38.94 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.699 0.799 . . . . 1.83 112.759 -176.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.96 -28.92 65.95 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 116.114 -0.493 . . . . 2.34 110.749 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.532 HG23 ' HB2' ' A' ' 61' ' ' PRO . 67.2 t -76.99 -48.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 N-CA-C 108.509 -0.923 . . . . 0.66 108.509 177.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.66 -30.74 63.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.955 -1.02 . . . . 0.51 112.097 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -89.15 -5.19 73.41 Favored Glycine 0 N--CA 1.439 -1.127 0 C-N-CA 120.051 -1.071 . . . . 0.61 113.009 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -98.53 -14.99 19.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.97 0.73 . . . . 3.98 112.97 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.53 HG21 HD23 ' A' ' 74' ' ' LEU . 26.7 m -79.66 121.56 33.18 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 CA-C-O 121.09 0.472 . . . . 0.44 110.933 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -93.16 -39.08 11.23 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.629 0.728 . . . . 1.91 110.911 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.45 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 34.9 p -115.42 138.47 23.73 Favored Pre-proline 0 N--CA 1.413 -2.316 0 CA-C-N 115.369 -0.832 . . . . 0.47 110.739 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.718 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 74.1 Cg_exo -52.75 -29.73 43.56 Favored 'Trans proline' 0 CA--C 1.508 -0.787 0 C-N-CA 124.34 3.36 . . . . 0.32 113.729 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -51.36 -44.93 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 123.439 0.462 . . . . 1.48 110.581 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 31.8 mt-10 -66.82 -49.28 66.29 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 123.982 0.913 . . . . 2.13 109.786 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.593 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -64.71 -43.61 92.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.743 -1.117 . . . . 0.9 110.193 -175.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' OD1' ' A' ' 79' ' ' ASN . 43.9 tp -57.28 -56.96 15.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 123.667 0.604 . . . . 0.34 109.98 178.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.66 -45.03 93.25 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 112.888 0.699 . . . . 0.57 112.888 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 73' ' ' GLU . 87.0 mt -61.77 -37.66 85.14 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 112.115 0.413 . . . . 1.96 112.115 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 64.7 mt -80.72 -35.57 14.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 C-N-CA 120.23 -0.588 . . . . 0.55 109.977 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.404 ' OD1' ' HG ' ' A' ' 75' ' ' LEU . 11.7 m120 -57.74 -40.94 80.84 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 110.383 -0.228 . . . . 1.14 110.383 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.61 -40.8 99.22 Favored Glycine 0 N--CA 1.45 -0.375 0 O-C-N 123.613 0.57 . . . . 0.53 112.033 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.27 -30.79 68.98 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.179 0.514 . . . . 0.6 110.458 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 86.6 mt -77.19 -34.19 56.26 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.719 -0.673 . . . . 1.42 110.444 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.684 0 CA-C-O 121.237 0.542 . . . . 0.85 110.777 177.054 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.3 mp . . . . . 0 C--O 1.25 1.081 0 N-CA-C 115.012 1.486 . . . . 1.51 115.012 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.493 HD11 HD22 ' A' ' 52' ' ' LEU . 82.3 mt -113.86 132.9 55.73 Favored 'General case' 0 CA--C 1.491 -1.319 0 CA-C-N 113.718 -1.583 . . . . 0.8 108.431 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.8 p -99.8 -174.78 2.79 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 108.909 -0.775 . . . . 0.63 108.909 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -57.75 -45.81 85.38 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.418 0.627 . . . . 0.61 109.31 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -61.18 -42.35 98.42 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 114.789 -1.096 . . . . 1.65 110.636 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.83 -40.73 88.1 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 115.666 -0.697 . . . . 1.41 111.413 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.417 HD11 HD12 ' A' ' 74' ' ' LEU . 15.9 tp -63.85 -38.44 91.1 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.539 -0.755 . . . . 0.48 109.31 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.523 ' O ' HG23 ' A' ' 15' ' ' VAL . 39.8 ttm105 -56.12 -54.35 46.17 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.526 -0.761 . . . . 2.46 109.998 173.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 8.6 tpt180 -57.43 -34.68 69.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 115.645 -0.707 . . . . 3.93 111.379 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.96 75.46 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.289 0.368 . . . . 0.5 110.275 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' OH ' ' A' ' 40' ' ' TYR . 10.6 mp -67.02 -24.28 66.0 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.116 0.413 . . . . 1.44 112.116 177.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 11' ' ' ARG . 97.2 t -68.46 -45.99 81.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.979 -0.749 . . . . 0.8 108.979 175.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 14.4 mm-40 -62.66 -44.95 94.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.698 -0.683 . . . . 2.05 112.829 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.569 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 3.9 p . . . . . 0 N--CA 1.433 -1.281 0 N-CA-C 112.64 0.608 . . . . 1.39 112.64 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 . . . . . 0 N--CA 1.444 -0.745 0 N-CA-C 108.551 -0.907 . . . . 2.07 108.551 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.485 ' HB2' HD12 ' A' ' 33' ' ' LEU . 18.6 p90 -126.48 20.33 7.31 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.896 -0.593 . . . . 0.44 109.947 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.768 ' HB3' ' HB2' ' A' ' 72' ' ' ARG . 22.2 mt -53.85 -31.31 49.02 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.144 1.164 . . . . 0.39 114.144 -178.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -95.63 -6.63 39.71 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.94 0.4 . . . . 2.04 111.24 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 30' ' ' PHE . 65.0 mt -82.18 109.96 16.95 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 106.796 -1.557 . . . . 1.37 106.796 176.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HD2' ' OD1' ' A' ' 69' ' ' ASP . 32.5 mtm105 -72.08 152.77 42.13 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.457 -0.571 . . . . 3.94 109.457 -173.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.63 -46.75 86.83 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.567 -0.531 . . . . 0.35 109.567 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -57.98 -23.28 53.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.814 0.446 . . . . 2.79 111.956 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -83.14 -28.74 29.19 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.165 0.507 . . . . 0.88 110.702 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.4 pt -97.24 13.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.303 0.573 . . . . 0.6 112.097 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.24 32.17 32.35 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.928 -0.653 . . . . 0.66 112.774 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.436 ' OH ' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-85 -115.97 105.48 12.7 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.169 0.509 . . . . 1.33 111.388 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -83.3 158.6 22.15 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.766 -1.198 . . . . 1.06 107.766 176.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.62 ' O ' ' HG3' ' A' ' 46' ' ' MET . 53.5 p -52.19 -31.08 30.0 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.377 0.88 . . . . 1.03 113.377 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.1 -51.32 64.57 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 120.982 0.42 . . . . 1.56 110.069 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.32 84.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.386 0.612 . . . . 0.43 109.886 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.492 HD21 HG23 ' A' ' 68' ' ' VAL . 52.9 tp -61.88 -45.44 93.75 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.43 110.717 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.62 ' HG3' ' O ' ' A' ' 42' ' ' SER . 54.0 mtt -62.81 -39.32 93.91 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 110.247 -0.279 . . . . 1.49 110.247 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -62.37 -37.64 86.48 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.768 0.795 . . . . 1.88 108.921 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.423 HG21 HD12 ' A' ' 14' ' ' LEU . 83.8 m -67.99 -57.63 5.85 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.502 -1.227 . . . . 0.45 108.082 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.521 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.06 -32.38 66.17 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 114.532 -1.213 . . . . 0.27 111.033 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.58 83.61 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.477 0.711 . . . . 0.33 111.721 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.569 ' NH2' ' HA ' ' A' ' 17' ' ' SER . 75.0 mtt180 -66.53 -39.9 88.85 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.84 -1.073 . . . . 2.84 109.064 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.493 HD22 HD11 ' A' ' 5' ' ' LEU . 90.3 mt -64.86 -40.56 95.35 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.143 -0.935 . . . . 0.9 110.029 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -56.3 -55.29 35.14 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.66 -0.7 . . . . 0.48 109.641 174.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.0 t -63.14 -44.38 95.69 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 115.096 -0.957 . . . . 1.19 111.731 -176.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.13 -49.6 71.51 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.817 0.673 . . . . 3.07 112.817 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.425 ' HB3' HD11 ' A' ' 82' ' ' LEU . 80.8 m-85 -94.13 -6.72 44.29 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 114.35 1.241 . . . . 1.01 114.35 -172.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.64 52.88 6.89 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.779 -1.2 . . . . 0.93 111.301 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.556 ' HB ' HD13 ' A' ' 82' ' ' LEU . 12.0 p -138.95 176.9 5.53 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 106.352 -1.721 . . . . 1.16 106.352 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 58' ' ' VAL . 17.1 t -141.7 145.08 34.46 Favored 'General case' 0 N--CA 1.415 -2.198 0 N-CA-C 108.712 -0.847 . . . . 1.87 108.712 177.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.521 HD12 ' HB1' ' A' ' 49' ' ' ALA . 64.4 mt -131.97 111.37 14.5 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.451 -1.314 . . . . 0.57 107.451 -178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.474 ' HB2' HG23 ' A' ' 64' ' ' VAL . 37.5 Cg_exo -62.02 128.97 25.67 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.7 2.267 . . . . 0.87 111.039 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 9.4 p-10 -55.06 -30.06 58.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.393 1.077 . . . . 1.83 112.48 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -68.36 -35.76 78.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.334 -0.617 . . . . 2.34 109.334 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.474 HG23 ' HB2' ' A' ' 61' ' ' PRO . 25.3 t -76.88 -47.68 27.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 108.382 -0.97 . . . . 0.66 108.382 176.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.15 -29.32 63.52 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 123.516 0.727 . . . . 0.51 112.509 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 42' ' ' SER . . . -85.55 -2.51 87.07 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.66 -0.781 . . . . 0.61 112.953 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -100.18 -24.62 14.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.639 0.219 . . . . 3.98 111.341 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.492 HG23 HD21 ' A' ' 45' ' ' LEU . 12.3 m -73.61 120.4 22.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.975 0.893 . . . . 0.44 111.728 -175.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 28.4 t70 -91.59 -47.48 7.38 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-N 114.233 -1.349 . . . . 1.91 112.386 -175.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 41.1 p -107.85 143.18 26.79 Favored Pre-proline 0 N--CA 1.408 -2.56 0 CA-C-N 116.014 -0.539 . . . . 0.47 110.91 -177.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.625 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 79.5 Cg_exo -53.74 -31.24 60.22 Favored 'Trans proline' 0 C--O 1.211 -0.839 0 C-N-CA 123.655 2.903 . . . . 0.32 111.706 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.768 ' HB2' ' HB3' ' A' ' 31' ' ' LEU . 25.0 ttp85 -51.4 -53.33 37.75 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 123.761 0.663 . . . . 1.48 111.03 174.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.84 -39.78 87.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.25 -0.432 . . . . 2.13 111.049 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.444 HD23 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -68.16 -44.85 75.05 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.406 -0.361 . . . . 0.9 111.207 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.2 tp -56.99 -50.06 73.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.22 -0.659 . . . . 0.34 109.22 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.54 -37.71 88.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.179 -0.918 . . . . 0.57 111.635 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.445 HD11 HG12 ' A' ' 64' ' ' VAL . 5.1 tt -58.3 -52.35 65.97 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 108.835 -0.802 . . . . 1.96 108.835 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.5 mt -64.56 -50.7 74.71 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 N-CA-C 109.131 -0.692 . . . . 0.55 109.131 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -51.2 -44.05 61.5 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.547 0.53 . . . . 1.14 111.871 -178.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.55 -48.73 48.79 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 121.237 -0.506 . . . . 0.53 112.456 178.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.92 79.41 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.122 0.487 . . . . 0.6 111.276 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.556 HD13 ' HB ' ' A' ' 58' ' ' VAL . 17.5 tp -70.95 -33.32 70.37 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.707 -0.679 . . . . 1.42 110.248 -177.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.655 0 CA-C-O 120.899 0.38 . . . . 0.85 111.212 175.401 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.4 tp . . . . . 0 N--CA 1.409 -2.519 0 N-CA-C 109.564 -0.532 . . . . 1.51 109.564 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.37 124.58 48.19 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.318 -0.623 . . . . 0.8 109.318 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.7 p -104.26 -170.82 1.82 Allowed 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.727 -1.212 . . . . 0.63 107.727 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.823 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.9 m -56.07 -49.55 73.48 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.152 0.501 . . . . 0.61 110.035 177.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.32 -43.3 88.12 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 114.89 -1.05 . . . . 1.65 110.267 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.13 -43.2 78.87 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.594 -0.73 . . . . 1.41 110.814 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.585 HD11 HD12 ' A' ' 74' ' ' LEU . 14.3 tp -65.19 -38.16 89.59 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.121 -0.945 . . . . 0.48 109.946 -175.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.503 ' O ' HG23 ' A' ' 15' ' ' VAL . 36.8 ttp180 -51.01 -52.65 40.8 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.203 -0.908 . . . . 2.46 110.39 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.635 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 79.0 ttt180 -57.69 -42.77 84.34 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.021 -0.536 . . . . 3.93 111.982 -177.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.21 84.66 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.151 0.282 . . . . 0.5 110.663 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.605 HD23 HG21 ' A' ' 48' ' ' THR . 97.2 mt -65.85 -41.73 91.35 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.941 -0.572 . . . . 1.44 110.17 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 11' ' ' ARG . 57.3 t -61.59 -49.97 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.198 0.599 . . . . 0.8 110.111 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.635 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 48.1 mm-40 -57.35 -45.43 84.35 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.728 -0.669 . . . . 2.05 109.845 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.8 m . . . . . 0 C--N 1.312 -1.023 0 CA-C-N 115.456 -0.793 . . . . 1.39 112.547 -175.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.823 ' HA ' HG21 ' A' ' 7' ' ' THR . 29.0 t70 . . . . . 0 CA--C 1.507 -0.704 0 N-CA-C 108.898 -0.778 . . . . 2.07 108.898 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -121.86 22.2 10.47 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.96 -0.564 . . . . 0.44 111.142 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 55.6 mt -52.55 -19.47 2.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.417 1.636 . . . . 0.39 115.417 -177.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -92.97 -19.7 21.35 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.403 0.144 . . . . 2.04 111.345 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.23 122.22 26.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 1.37 110.281 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.531 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 34.6 mtm105 -77.8 145.85 36.14 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.962 -0.563 . . . . 3.94 109.798 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.56 ' HA ' HG12 ' A' ' 38' ' ' ILE . 46.6 m-85 -61.97 -42.08 98.73 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.582 -0.281 . . . . 0.35 110.795 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.94 -38.59 70.53 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.381 0.61 . . . . 2.79 110.24 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.11 -22.55 42.02 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.43 -0.805 . . . . 0.88 111.069 -173.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.6 pt -92.3 13.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.751 0.786 . . . . 0.6 110.55 177.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.91 87.5 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.571 -0.74 . . . . 0.66 113.81 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -81.83 131.86 35.27 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 112.189 0.441 . . . . 1.33 112.189 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.14 142.46 30.34 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.216 -1.772 . . . . 1.06 106.216 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 46' ' ' MET . 33.7 p -54.12 -31.98 53.76 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.522 0.934 . . . . 1.03 113.522 179.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.2 tp -64.68 -42.1 95.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.89 0.376 . . . . 1.56 110.234 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.62 -36.37 84.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.506 0.669 . . . . 0.43 109.709 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.505 HD21 HG23 ' A' ' 68' ' ' VAL . 54.7 tp -63.92 -45.23 90.2 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.205 -0.907 . . . . 0.43 109.931 176.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 42' ' ' SER . 83.3 mtp -61.89 -38.28 87.75 Favored 'General case' 0 C--O 1.196 -1.714 0 CA-C-N 115.931 -0.577 . . . . 1.49 110.258 176.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.8 tp10 -60.96 -35.2 76.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.806 0.842 . . . . 1.88 109.871 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.605 HG21 HD23 ' A' ' 14' ' ' LEU . 87.3 m -66.61 -57.33 7.44 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.566 -1.272 . . . . 0.45 107.566 -178.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.525 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.12 -43.61 74.26 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 113.725 -1.58 . . . . 0.27 109.567 177.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.07 91.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.75 0.82 . . . . 0.33 113.038 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 84.1 mtt180 -66.47 -38.27 86.96 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.23 -0.441 . . . . 2.84 109.989 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.62 -38.05 89.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.872 -0.604 . . . . 0.9 109.926 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.525 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -57.29 -55.12 38.83 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.642 -0.503 . . . . 0.48 109.642 173.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 59.2 p -61.19 -38.06 85.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.679 0.612 . . . . 1.19 112.504 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -71.01 -46.27 62.48 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.63 0.974 . . . . 3.07 113.63 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -101.74 -13.97 17.53 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 114.697 1.369 . . . . 1.01 114.697 -172.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.5 40.32 Favored Glycine 0 C--N 1.308 -0.986 0 C-N-CA 120.099 -1.048 . . . . 0.93 110.885 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.48 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 4.1 p -97.09 135.31 31.68 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 N-CA-C 109.126 -0.694 . . . . 1.16 109.126 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 m -96.77 106.07 18.3 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 109.92 -0.4 . . . . 1.87 109.92 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.408 ' CD1' ' HB1' ' A' ' 49' ' ' ALA . 67.9 mt -102.19 117.45 61.25 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 110.362 -0.236 . . . . 0.57 110.362 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.78 131.21 26.78 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.222 1.948 . . . . 0.87 110.329 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -51.88 -34.1 39.62 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.634 0.976 . . . . 1.83 113.634 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.634 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 3.4 m-20 -66.44 -45.62 79.22 Favored 'General case' 0 CA--C 1.495 -1.15 0 CA-C-O 120.566 0.222 . . . . 2.34 110.777 -178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.5 t -71.27 -31.68 44.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.538 -0.542 . . . . 0.66 109.538 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.82 -22.51 58.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.911 -0.586 . . . . 0.51 112.228 177.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.61 0.84 27.65 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 120.553 -0.832 . . . . 0.61 111.923 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 4.6 mmp_? -96.41 -15.11 21.98 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.185 -0.672 . . . . 3.98 109.185 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.525 HG21 HD23 ' A' ' 74' ' ' LEU . 19.5 m -76.85 91.84 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 CA-C-O 122.559 1.171 . . . . 0.44 109.641 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.531 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 18.9 t70 -86.23 -35.57 19.94 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 114.417 -1.265 . . . . 1.91 111.375 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.479 HG22 ' HG2' ' A' ' 34' ' ' ARG . 45.0 p -113.75 149.17 41.33 Favored Pre-proline 0 C--N 1.284 -2.255 0 N-CA-C 109.355 -0.609 . . . . 0.47 109.355 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.477 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.6 Cg_exo -52.27 -39.99 71.01 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.561 2.841 . . . . 0.32 112.949 -178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.9 ptp85 -50.86 -40.94 57.42 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 123.715 0.634 . . . . 1.48 112.52 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.01 -52.6 58.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.059 0.457 . . . . 2.13 110.802 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.585 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -67.86 -42.05 81.94 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.083 -0.962 . . . . 0.9 109.99 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' OD1' ' A' ' 79' ' ' ASN . 32.9 tp -56.41 -57.02 14.08 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.524 -0.762 . . . . 0.34 109.321 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.73 -39.2 80.17 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.926 -0.579 . . . . 0.57 112.253 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.04 -46.45 89.49 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.214 0.53 . . . . 1.96 109.633 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.44 -36.73 20.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-N 116.069 -0.514 . . . . 0.55 110.292 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.404 ' OD1' ' HG ' ' A' ' 75' ' ' LEU . 11.4 m120 -56.96 -47.03 81.69 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.223 0.209 . . . . 1.14 110.95 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.53 -39.68 97.67 Favored Glycine 0 N--CA 1.447 -0.592 0 O-C-N 123.552 0.533 . . . . 0.53 112.155 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.37 75.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.023 0.44 . . . . 0.6 110.518 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.9 mt -68.24 -33.97 75.36 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.97 -0.559 . . . . 1.42 110.691 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 123.428 0.691 . . . . 0.85 111.917 179.327 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.441 -0.876 0 N-CA-C 112.641 0.608 . . . . 1.51 112.641 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.492 HD22 ' OD1' ' A' ' 9' ' ' ASP . 88.3 mt -126.52 147.45 49.84 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 108.672 -0.862 . . . . 0.8 108.672 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.8 p -99.43 172.78 7.11 Favored 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 107.372 -1.344 . . . . 0.63 107.372 174.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.708 HG21 ' HA ' ' A' ' 29' ' ' ASP . 21.0 m -58.9 -31.25 68.44 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.278 -0.638 . . . . 0.61 109.278 172.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -66.02 -50.68 63.37 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.356 -0.838 . . . . 1.65 111.716 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.492 ' OD1' HD22 ' A' ' 5' ' ' LEU . 15.4 t70 -68.44 -37.8 80.57 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.347 -0.541 . . . . 1.41 109.909 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 75' ' ' LEU . 18.4 tp -62.67 -42.95 99.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.28 -0.873 . . . . 0.48 108.984 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 15' ' ' VAL . 42.2 ttp180 -50.35 -38.19 40.83 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 124.507 1.123 . . . . 2.46 111.12 178.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.694 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 59.6 ttt180 -56.25 -51.39 68.28 Favored 'General case' 0 C--O 1.216 -0.665 0 O-C-N 123.592 0.557 . . . . 3.93 110.724 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.45 -37.17 84.85 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 123.379 0.424 . . . . 0.5 111.909 -174.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.52 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.84 -29.66 69.64 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.312 -0.404 . . . . 1.44 111.296 176.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 11' ' ' ARG . 61.8 t -77.67 -39.97 27.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.401 -0.592 . . . . 0.8 109.401 176.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.694 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 6.7 mm-40 -55.99 -53.18 60.01 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.015 0.926 . . . . 2.05 110.655 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m . . . . . 0 C--N 1.313 -1.007 0 CA-C-N 115.552 -0.749 . . . . 1.39 111.866 -174.713 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.708 ' HA ' HG21 ' A' ' 7' ' ' THR . 12.0 t70 . . . . . 0 CA--C 1.496 -1.122 0 N-CA-C 108.049 -1.093 . . . . 2.07 108.049 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.439 ' CZ ' ' HG ' ' A' ' 14' ' ' LEU . 11.8 p90 -137.66 20.13 2.89 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.793 -0.363 . . . . 0.44 110.177 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.743 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 75.7 mt -54.98 -22.42 15.19 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.15 0.796 . . . . 0.39 113.15 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -92.12 -14.59 28.94 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.733 0.813 . . . . 2.04 111.0 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 30' ' ' PHE . 4.0 mm? -80.11 131.77 35.81 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 115.891 -0.595 . . . . 1.37 109.978 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.645 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 14.3 mmt180 -76.65 137.56 39.51 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.371 -0.603 . . . . 3.94 109.371 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.639 ' HB3' ' HB3' ' A' ' 40' ' ' TYR . 47.2 m-85 -62.76 -37.72 87.74 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 107.638 -1.245 . . . . 0.35 107.638 175.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -55.45 -33.92 64.03 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.418 -1.265 . . . . 2.79 110.332 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.3 -35.08 28.34 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 115.983 -0.553 . . . . 0.88 110.617 -176.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.467 HG13 ' HB2' ' A' ' 40' ' ' TYR . 38.0 pt -90.44 16.14 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.404 -0.518 . . . . 0.6 111.042 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 28.74 73.91 Favored Glycine 0 C--O 1.238 0.39 0 CA-C-N 115.341 -0.845 . . . . 0.66 113.236 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.639 ' HB3' ' HB3' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -97.37 114.03 25.78 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 109.469 -0.567 . . . . 1.33 109.469 -177.694 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.11 149.98 25.17 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 116.053 -0.521 . . . . 1.06 110.547 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 77.6 p -50.74 -33.94 25.09 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.916 1.08 . . . . 1.03 113.916 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.31 -49.42 69.55 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.841 -0.8 . . . . 1.56 108.841 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.07 -37.91 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.723 -0.671 . . . . 0.43 109.838 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.662 HD21 HG23 ' A' ' 68' ' ' VAL . 63.5 tp -62.95 -46.39 87.97 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.393 -0.821 . . . . 0.43 110.994 177.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 67.6 mtt -63.05 -36.56 83.99 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 110.168 -0.308 . . . . 1.49 110.168 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 37.9 tt0 -64.55 -31.26 72.4 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.501 0.667 . . . . 1.88 110.831 176.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.52 HG21 HD13 ' A' ' 14' ' ' LEU . 96.8 m -66.06 -55.49 16.29 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.462 -1.31 . . . . 0.45 107.462 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.508 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.71 -38.63 72.59 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 113.909 -1.496 . . . . 0.27 109.795 175.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.8 78.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.486 0.714 . . . . 0.33 111.63 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 71.3 mtt180 -63.67 -39.38 94.2 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.365 -0.834 . . . . 2.84 109.933 179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 59.2 mt -65.36 -41.96 93.27 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.068 0.396 . . . . 0.9 112.068 176.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.8 mt-10 -57.59 -48.62 78.9 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 122.325 0.25 . . . . 0.48 110.544 175.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -63.43 -44.51 94.36 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.389 0.614 . . . . 1.19 111.428 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -65.99 -44.12 85.78 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.154 -0.93 . . . . 3.07 112.844 -176.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.402 ' CE2' HD21 ' A' ' 5' ' ' LEU . 80.0 m-85 -101.57 -18.59 15.85 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 115.296 1.591 . . . . 1.01 115.296 -177.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.84 62.37 1.77 Allowed Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.257 -0.973 . . . . 0.93 111.434 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.1 m -139.21 177.77 4.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 C-N-CA 123.523 0.729 . . . . 1.16 110.125 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -140.22 115.95 10.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 123.632 0.583 . . . . 1.87 109.855 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.508 HD12 ' HB1' ' A' ' 49' ' ' ALA . 86.4 mt -101.01 130.31 25.34 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.461 -0.79 . . . . 0.57 110.294 -177.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.93 126.75 22.02 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.781 2.321 . . . . 0.87 111.647 176.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -51.35 -54.01 30.64 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.854 1.262 . . . . 1.83 113.658 -173.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.11 -28.45 63.29 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 116.235 -0.439 . . . . 2.34 111.66 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.79 -37.62 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.462 -0.94 . . . . 0.66 108.462 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.93 -24.99 60.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.105 -0.952 . . . . 0.51 111.377 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.56 11.98 39.16 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 121.057 -0.592 . . . . 0.61 112.618 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -105.23 -21.62 13.22 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.378 0.608 . . . . 3.98 110.535 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.662 HG23 HD21 ' A' ' 45' ' ' LEU . 28.6 m -76.64 115.67 18.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 121.597 0.713 . . . . 0.44 111.286 -176.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.645 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 33.3 t70 -97.79 -23.76 15.75 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 121.62 0.724 . . . . 1.91 110.533 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.431 HG22 ' HD3' ' A' ' 34' ' ' ARG . 70.7 p -116.75 143.97 32.45 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.512 -0.767 . . . . 0.47 110.897 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.743 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 39.4 Cg_exo -59.36 -30.82 93.74 Favored 'Trans proline' 0 C--O 1.204 -1.204 0 C-N-CA 123.308 2.672 . . . . 0.32 112.352 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.553 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 6.0 ptp180 -54.75 -44.78 73.91 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.12 -0.232 . . . . 1.48 111.329 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.2 -46.19 81.71 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.197 0.522 . . . . 2.13 109.829 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.461 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.1 -45.13 82.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.263 -0.881 . . . . 0.9 110.553 -176.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.515 ' HB2' HD22 ' A' ' 10' ' ' LEU . 61.8 tp -57.2 -54.19 49.59 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 109.454 -0.573 . . . . 0.34 109.454 176.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -59.99 -37.73 80.54 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 123.908 0.755 . . . . 0.57 111.804 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.92 -50.1 74.78 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 122.925 0.49 . . . . 1.96 110.522 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.8 mt -70.41 -31.13 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.566 -0.531 . . . . 0.55 109.566 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -39.61 93.62 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-N 116.067 -0.515 . . . . 1.14 109.647 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.58 -38.9 93.7 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.857 -0.497 . . . . 0.53 111.857 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.84 -37.89 79.44 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.23 0.538 . . . . 0.6 110.194 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.7 mt -74.93 -20.92 59.49 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.908 -0.587 . . . . 1.42 111.117 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-O 121.027 0.441 . . . . 0.85 110.536 174.306 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.434 ' HA ' HD13 ' A' ' 82' ' ' LEU . 11.7 tp . . . . . 0 N--CA 1.411 -2.391 0 CA-C-O 121.237 0.541 . . . . 1.51 111.398 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.601 ' HG ' HD11 ' A' ' 82' ' ' LEU . 79.8 mt -98.5 129.07 45.08 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 115.091 -0.959 . . . . 0.8 108.42 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -96.6 -171.97 2.39 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 107.144 -1.428 . . . . 0.63 107.144 173.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 m -56.73 -38.91 73.03 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.265 0.555 . . . . 0.61 110.218 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.79 -41.1 60.63 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 111.367 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.94 -36.03 83.07 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.896 -0.779 . . . . 1.41 108.896 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.475 HD11 ' CD1' ' A' ' 74' ' ' LEU . 19.7 tp -66.21 -50.88 62.32 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.829 -1.078 . . . . 0.48 108.474 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.414 ' O ' HG23 ' A' ' 15' ' ' VAL . 11.9 ttp180 -50.33 -42.13 52.38 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.82 0.7 . . . . 2.46 111.509 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -53.21 -47.04 69.25 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.727 0.642 . . . . 3.93 110.325 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.569 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -66.06 -42.83 88.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.696 -0.684 . . . . 0.5 112.085 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.65 HD13 HG21 ' A' ' 48' ' ' THR . 4.1 mm? -64.08 -34.79 78.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.008 0.433 . . . . 1.44 111.157 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 11' ' ' ARG . 95.1 t -69.55 -25.03 27.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 120.997 0.427 . . . . 0.8 111.499 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 5.6 mm-40 -63.35 -45.96 88.76 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.174 0.511 . . . . 2.05 111.822 177.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 p . . . . . 0 C--N 1.315 -0.923 0 CA-C-O 121.443 0.64 . . . . 1.39 110.919 -179.588 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 CA--C 1.51 -0.59 0 N-CA-C 108.939 -0.763 . . . . 2.07 108.939 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -133.52 14.73 4.08 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.104 -0.638 . . . . 0.44 111.17 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.777 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 42.4 mt -52.86 -31.96 42.21 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 114.071 1.137 . . . . 0.39 114.071 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -94.29 -7.42 41.98 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 116.276 -0.42 . . . . 2.04 111.86 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mp -84.84 123.58 30.62 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.741 -1.207 . . . . 1.37 107.741 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -73.95 145.65 44.53 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 109.71 -0.478 . . . . 3.94 109.71 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.545 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 51.9 m-85 -61.49 -36.42 80.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.368 -0.605 . . . . 0.35 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -56.28 -36.78 68.99 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.318 -0.856 . . . . 2.79 110.726 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.9 -35.43 37.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.837 -0.62 . . . . 0.88 110.141 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -93.27 12.91 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 113.267 0.84 . . . . 0.6 113.267 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.49 41.11 30.91 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.051 -0.595 . . . . 0.66 114.27 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.545 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 13.7 m-85 -116.95 110.23 18.03 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 122.625 0.37 . . . . 1.33 110.724 176.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -88.46 155.09 19.86 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 120.562 -0.455 . . . . 1.06 110.313 174.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.416 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 79.4 p -51.94 -33.42 37.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.315 1.228 . . . . 1.03 114.315 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.26 -51.78 58.61 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.886 -0.413 . . . . 1.56 109.886 -178.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.49 89.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.498 0.666 . . . . 0.43 110.058 175.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.515 ' O ' ' HB ' ' A' ' 48' ' ' THR . 60.0 tp -62.37 -47.55 83.66 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.138 -0.937 . . . . 0.43 110.945 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 42' ' ' SER . 62.1 mtm -63.87 -37.23 86.61 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 122.443 -0.161 . . . . 1.49 110.796 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 40.2 tt0 -62.2 -31.43 71.95 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.49 0.662 . . . . 1.88 109.912 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.65 HG21 HD13 ' A' ' 14' ' ' LEU . 65.2 m -66.67 -56.9 8.49 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.591 -1.263 . . . . 0.45 107.591 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.506 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.34 -35.48 69.95 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 114.384 -1.28 . . . . 0.27 110.553 176.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.47 -44.05 84.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.411 0.684 . . . . 0.33 111.933 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.636 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 44.2 mtt180 -64.78 -37.12 86.54 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.303 -0.862 . . . . 2.84 109.412 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 13' ' ' ALA . 98.2 mt -67.62 -45.86 74.21 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.21 -0.905 . . . . 0.9 111.286 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.2 mt-10 -54.43 -51.99 63.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 123.093 0.557 . . . . 0.48 110.214 178.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 m -61.91 -48.85 78.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 114.943 -1.026 . . . . 1.19 111.829 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.46 HH11 ' HD3' ' A' ' 55' ' ' ARG . 12.0 ttm180 -65.6 -48.65 71.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.392 0.515 . . . . 3.07 112.392 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -91.86 2.57 56.44 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.215 0.82 . . . . 1.01 113.215 -171.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.71 56.5 18.74 Favored Glycine 0 C--O 1.25 1.102 0 CA-C-N 116.163 -0.471 . . . . 0.93 112.265 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.482 HG22 ' H ' ' A' ' 59' ' ' SER . 8.7 p -138.68 176.25 6.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 N-CA-C 107.962 -1.125 . . . . 1.16 107.962 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 58' ' ' VAL . 68.8 m -141.17 138.89 33.72 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 109.606 -0.516 . . . . 1.87 109.606 178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.506 HD12 ' HB1' ' A' ' 49' ' ' ALA . 65.6 mt -130.62 120.99 18.96 Favored Pre-proline 0 C--N 1.308 -1.223 0 N-CA-C 108.638 -0.875 . . . . 0.57 108.638 -177.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.416 ' HB2' HG23 ' A' ' 64' ' ' VAL . 38.1 Cg_exo -62.2 124.72 14.88 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.581 2.187 . . . . 0.87 110.175 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.408 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 5.4 p-10 -51.66 -31.53 25.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.713 1.205 . . . . 1.83 112.946 -177.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -69.02 -38.41 79.2 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.934 0.397 . . . . 2.34 110.546 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' A' ' 61' ' ' PRO . 21.3 t -75.59 -41.8 41.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.0 -1.111 . . . . 0.66 108.0 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -28.16 66.62 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 115.639 -0.71 . . . . 0.51 111.689 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.42 10.77 59.68 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 121.005 -0.617 . . . . 0.61 112.036 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -101.3 -24.39 14.23 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.837 -0.801 . . . . 3.98 108.837 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.568 HG21 HD23 ' A' ' 74' ' ' LEU . 30.3 m -79.14 97.55 2.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-O 122.245 1.022 . . . . 0.44 110.775 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -88.02 -21.01 25.03 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.273 -0.876 . . . . 1.91 111.221 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 p -121.39 142.87 36.31 Favored Pre-proline 0 N--CA 1.413 -2.319 0 CA-C-N 115.998 -0.546 . . . . 0.47 109.572 179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.777 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.7 Cg_exo -53.24 -34.9 71.8 Favored 'Trans proline' 0 CA--C 1.514 -0.478 0 C-N-CA 123.616 2.877 . . . . 0.32 113.34 -178.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -52.79 -44.22 66.43 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 123.475 0.485 . . . . 1.48 110.878 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB3' HG12 ' A' ' 68' ' ' VAL . 60.9 mm-40 -65.46 -47.96 74.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.262 0.625 . . . . 2.13 110.516 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.568 HD23 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -66.99 -42.93 84.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.323 -0.853 . . . . 0.9 110.333 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 51.1 tp -58.33 -50.2 74.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.636 -0.505 . . . . 0.34 109.636 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.42 -41.77 90.3 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.545 0.738 . . . . 0.57 111.094 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.97 -57.18 14.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.029 0.932 . . . . 1.96 108.738 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.3 mt -68.64 -31.85 52.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.51 0 CA-C-N 115.699 -0.682 . . . . 0.55 111.425 -176.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.77 -44.32 93.93 Favored 'General case' 0 N--CA 1.481 1.114 0 O-C-N 122.187 -0.32 . . . . 1.14 110.505 175.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.72 -39.58 90.21 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.378 -0.689 . . . . 0.53 111.378 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.62 -35.33 75.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.64 0.376 . . . . 0.6 111.455 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.601 HD11 ' HG ' ' A' ' 5' ' ' LEU . 55.6 mt -68.67 -31.96 71.46 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 122.927 0.491 . . . . 1.42 111.861 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.572 0 CA-C-O 121.217 0.532 . . . . 0.85 111.294 177.599 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.3 tp . . . . . 0 N--CA 1.405 -2.718 0 CA-C-O 121.272 0.558 . . . . 1.51 109.928 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.474 HD21 ' CE2' ' A' ' 56' ' ' TYR . 87.5 mt -93.97 130.09 40.21 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.225 -0.898 . . . . 0.8 112.076 -174.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.0 p -99.01 -173.83 2.61 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 106.478 -1.675 . . . . 0.63 106.478 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.6 m -56.72 -46.72 81.14 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 118.589 0.631 . . . . 0.61 109.866 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.27 -39.83 93.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.596 0.591 . . . . 1.65 112.596 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.14 -39.97 93.76 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 109.034 -0.728 . . . . 1.41 109.034 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.441 HD11 HD12 ' A' ' 74' ' ' LEU . 19.7 tp -66.17 -51.93 53.03 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 114.927 -1.033 . . . . 0.48 108.294 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 15' ' ' VAL . 37.7 ttm180 -46.98 -47.37 21.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.251 1.42 . . . . 2.46 111.498 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.589 ' HD2' HH22 ' A' ' 55' ' ' ARG . 29.1 ttm180 -56.39 -48.92 75.91 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.857 0.723 . . . . 3.93 110.291 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.21 -37.98 89.4 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.836 -0.62 . . . . 0.5 111.095 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.432 HD13 HG21 ' A' ' 48' ' ' THR . 4.4 mm? -62.93 -45.12 93.97 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.054 -0.351 . . . . 1.44 110.054 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 11' ' ' ARG . 85.5 t -60.0 -52.39 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 109.73 -0.47 . . . . 0.8 109.73 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.409 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.0 mt-10 -57.55 -41.82 81.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.16 -0.473 . . . . 2.05 111.677 -178.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.541 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.0 m . . . . . 0 C--N 1.315 -0.905 0 N-CA-C 112.038 0.385 . . . . 1.39 112.038 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 t70 . . . . . 0 N--CA 1.439 -0.994 0 N-CA-C 107.547 -1.279 . . . . 2.07 107.547 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.448 ' HA ' HD13 ' A' ' 33' ' ' LEU . 30.9 p90 -135.12 15.55 3.51 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.284 -0.566 . . . . 0.44 111.863 -174.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 65.0 mt -52.87 -24.86 9.97 Favored 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 116.115 1.895 . . . . 0.39 116.115 -175.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -95.21 -12.25 26.63 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.057 0.39 . . . . 2.04 111.798 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.448 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.3 mp -81.17 119.77 24.01 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.421 -0.585 . . . . 1.37 109.421 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 141.55 41.63 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.298 -1.001 . . . . 3.94 108.298 -178.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.5 m-85 -58.6 -37.95 76.95 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.47 0.481 . . . . 0.35 111.409 -176.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.49 -33.81 64.03 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.37 0.668 . . . . 2.79 111.364 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -82.62 -31.74 28.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.88 110.74 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.416 HG13 ' HD1' ' A' ' 40' ' ' TYR . 24.0 pt -93.16 22.52 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 N-CA-C 112.436 0.532 . . . . 0.6 112.436 -177.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.69 35.4 55.15 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.878 -0.601 . . . . 0.66 113.961 173.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 14.4 m-85 -108.24 116.9 32.82 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 112.582 0.586 . . . . 1.33 112.582 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -82.68 147.01 28.75 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 106.687 -1.597 . . . . 1.06 106.687 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 p -53.3 -35.93 60.65 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.754 1.02 . . . . 1.03 113.754 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.41 -46.93 71.75 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 109.273 -0.64 . . . . 1.56 109.273 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -61.45 -33.59 74.0 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.524 0.678 . . . . 0.43 110.33 176.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.414 ' O ' ' HB ' ' A' ' 48' ' ' THR . 51.4 tp -63.75 -51.27 65.65 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.436 -0.802 . . . . 0.43 109.95 175.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.5 mtm -63.79 -30.84 71.89 Favored 'General case' 0 C--O 1.206 -1.224 0 CA-C-N 116.36 -0.382 . . . . 1.49 111.227 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.446 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 8.5 tp10 -60.96 -37.89 83.98 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.551 1.14 . . . . 1.88 109.325 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.541 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 71.7 m -67.19 -56.7 8.83 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 113.998 -1.455 . . . . 0.45 107.953 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.525 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -56.69 -34.99 67.94 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.39 -1.277 . . . . 0.27 110.419 176.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.451 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -59.16 -41.93 89.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.303 0.641 . . . . 0.33 111.549 179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.2 mtt180 -64.86 -42.0 95.23 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.792 -0.64 . . . . 2.84 109.33 176.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 49' ' ' ALA . 91.6 mt -61.71 -41.66 97.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.239 -0.437 . . . . 0.9 110.456 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.0 mt-10 -57.13 -56.38 22.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.878 -0.601 . . . . 0.48 110.139 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 t -62.77 -50.68 70.07 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.032 -0.986 . . . . 1.19 111.374 -177.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.589 HH22 ' HD2' ' A' ' 12' ' ' ARG . 65.4 ttt180 -63.26 -44.28 95.6 Favored 'General case' 0 C--N 1.313 -0.993 0 C-N-CA 125.05 1.34 . . . . 3.07 113.301 -175.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.474 ' CE2' HD21 ' A' ' 5' ' ' LEU . 92.4 m-85 -97.07 -12.53 23.07 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.612 -0.835 . . . . 1.01 113.178 -176.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 56.65 2.95 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.109 -1.043 . . . . 0.93 110.594 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.473 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 12.6 p -139.51 176.3 6.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.676 -1.231 . . . . 1.16 107.676 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 58' ' ' VAL . 8.1 t -141.96 136.23 30.15 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.973 -1.121 . . . . 1.87 107.973 177.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.429 HD12 ' HB1' ' A' ' 49' ' ' ALA . 69.2 mt -124.14 126.57 25.55 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.328 -0.249 . . . . 0.57 110.328 -175.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.2 131.45 41.3 Favored 'Trans proline' 0 C--O 1.247 0.96 0 C-N-CA 122.836 2.357 . . . . 0.87 111.573 175.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.26 -40.65 64.78 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.935 1.294 . . . . 1.83 112.496 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 14.9 t70 -66.31 -40.89 90.27 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.111 -0.495 . . . . 2.34 111.002 -178.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.2 t -72.63 -40.04 61.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 109.229 -0.656 . . . . 0.66 109.229 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.3 65.82 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.528 -0.76 . . . . 0.51 111.696 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.44 11.47 39.45 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.629 -0.796 . . . . 0.61 112.506 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 11.3 tpt180 -97.14 -20.0 18.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.698 0.761 . . . . 3.98 109.841 -177.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.521 HG21 HD23 ' A' ' 74' ' ' LEU . 24.3 m -79.2 117.11 24.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-N 115.093 -0.958 . . . . 0.44 112.229 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -94.4 -39.05 10.66 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 115.506 -0.77 . . . . 1.91 110.677 175.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 47.0 p -104.65 136.91 19.11 Favored Pre-proline 0 N--CA 1.407 -2.589 0 CA-C-N 115.723 -0.671 . . . . 0.47 111.112 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.59 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.8 Cg_exo -52.17 -35.69 63.86 Favored 'Trans proline' 0 CA--C 1.516 -0.411 0 C-N-CA 124.079 3.186 . . . . 0.32 113.787 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -53.42 -42.66 67.26 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.851 0.315 . . . . 1.48 111.851 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -65.14 -46.01 82.68 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.184 0.594 . . . . 2.13 110.55 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.521 HD23 HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -65.84 -48.74 70.6 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.11 -0.95 . . . . 0.9 109.411 -178.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.01 -54.59 45.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.34 110.922 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.12 -40.61 98.11 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 112.626 0.602 . . . . 0.57 112.626 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.23 -48.65 80.5 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 108.86 -0.793 . . . . 1.96 108.86 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 65.9 mt -67.16 -35.16 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 116.074 -0.512 . . . . 0.55 110.702 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -57.41 -43.45 83.77 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 110.124 -0.324 . . . . 1.14 110.124 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.48 -40.22 97.52 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.825 -0.625 . . . . 0.53 111.919 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.5 -41.99 71.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.104 0.478 . . . . 0.6 111.032 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.32 -31.43 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 1.42 111.855 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.494 0 CA-C-O 120.966 0.412 . . . . 0.85 111.688 -179.313 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.7 mp . . . . . 0 CA--C 1.487 -1.472 0 CA-C-O 121.266 0.555 . . . . 1.51 109.813 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.528 ' H ' HD22 ' A' ' 5' ' ' LEU . 1.4 mm? -71.62 139.41 49.3 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.763 -1.108 . . . . 0.8 109.732 -176.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.7 p -97.64 -170.69 2.04 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 105.181 -2.155 . . . . 0.63 105.181 167.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.836 HG21 ' HA ' ' A' ' 29' ' ' ASP . 41.8 m -56.92 -47.54 80.37 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 119.244 0.929 . . . . 0.61 110.123 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.8 -48.36 79.94 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.977 -0.556 . . . . 1.65 112.387 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HB3' HD12 ' A' ' 5' ' ' LEU . 16.2 m-20 -66.15 -38.6 88.5 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.134 -0.484 . . . . 1.41 110.484 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.426 HD22 HD13 ' A' ' 75' ' ' LEU . 16.5 tp -66.95 -46.8 73.58 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 108.4 -0.963 . . . . 0.48 108.4 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.407 ' O ' HG23 ' A' ' 15' ' ' VAL . 41.1 ttp180 -53.54 -46.48 70.2 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 123.792 0.837 . . . . 2.46 110.858 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.5 ttt180 -54.33 -50.55 67.13 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.391 0.432 . . . . 3.93 110.251 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.42 -40.65 95.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.752 -0.658 . . . . 0.5 111.351 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.412 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 10.2 mp -64.21 -44.03 93.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.875 -0.33 . . . . 1.44 111.786 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 11' ' ' ARG . 96.9 t -60.93 -45.42 98.38 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 N-CA-C 109.928 -0.397 . . . . 0.8 109.928 178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 42.3 mt-10 -60.58 -47.52 85.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 2.05 110.955 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.539 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 38.9 m . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.642 -0.708 . . . . 1.39 112.484 -177.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.836 ' HA ' HG21 ' A' ' 7' ' ' THR . 11.5 t70 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 106.101 -1.815 . . . . 2.07 106.101 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -110.46 25.57 11.64 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.706 -0.679 . . . . 0.44 112.35 -169.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.78 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 50.6 mt -50.36 -27.75 6.84 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.061 1.874 . . . . 0.39 116.061 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -97.58 -5.19 36.18 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 118.43 0.559 . . . . 2.04 112.061 -177.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.431 HD23 HG21 ' A' ' 38' ' ' ILE . 9.4 mp -77.18 125.14 28.84 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.525 -0.734 . . . . 1.37 111.115 -177.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.442 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 10.4 mpt_? -73.74 129.62 38.29 Favored 'General case' 0 C--O 1.247 0.951 0 N-CA-C 108.438 -0.949 . . . . 3.94 108.438 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.473 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 80.6 m-85 -55.05 -50.37 69.27 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.296 0.997 . . . . 0.35 113.399 -173.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -53.51 -27.04 23.43 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 113.179 0.807 . . . . 2.79 113.179 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.78 -33.05 27.44 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.371 0.605 . . . . 0.88 110.187 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.431 HG21 HD23 ' A' ' 33' ' ' LEU . 12.6 pt -96.75 22.81 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 112.958 0.725 . . . . 0.6 112.958 -175.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.17 21.77 54.02 Favored Glycine 0 CA--C 1.506 -0.483 0 CA-C-N 115.799 -0.637 . . . . 0.66 113.997 174.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.473 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 26.6 m-85 -123.06 102.6 8.08 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 112.023 0.379 . . . . 1.33 112.023 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -82.34 147.22 28.96 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 106.914 -1.513 . . . . 1.06 106.914 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.581 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 23.8 m -50.01 -22.44 1.59 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.839 1.051 . . . . 1.03 113.839 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.57 -58.76 5.46 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.764 -0.585 . . . . 1.56 110.006 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -62.68 -26.83 68.86 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.645 0.736 . . . . 0.43 109.86 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.581 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 28.8 tp -64.28 -47.23 80.32 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 115.393 -0.821 . . . . 0.43 110.251 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.579 ' HG3' ' O ' ' A' ' 42' ' ' SER . 56.0 mtm -63.58 -33.12 74.89 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 110.051 -0.352 . . . . 1.49 110.051 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.496 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 10.9 tp10 -60.55 -37.82 82.48 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 121.957 0.884 . . . . 1.88 109.349 176.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.468 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 79.4 m -70.14 -55.98 8.03 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.319 -1.309 . . . . 0.45 107.866 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.652 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -54.9 -36.03 64.76 Favored 'General case' 0 C--O 1.203 -1.356 0 CA-C-N 114.0 -1.455 . . . . 0.27 110.809 178.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.52 83.62 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-O 121.538 0.685 . . . . 0.33 112.015 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.539 ' CZ ' ' HA ' ' A' ' 17' ' ' SER . 77.6 mtt180 -68.9 -37.83 79.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.279 -0.873 . . . . 2.84 109.599 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.652 HD12 ' HA ' ' A' ' 49' ' ' ALA . 56.8 mt -62.75 -46.32 88.6 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.903 -1.044 . . . . 0.9 109.557 176.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -55.98 -58.06 9.49 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.606 -0.725 . . . . 0.48 111.218 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.0 t -63.13 -56.37 17.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.38 -0.827 . . . . 1.19 112.284 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.548 ' HD2' ' CZ ' ' A' ' 56' ' ' TYR . 35.5 ttm180 -65.02 -43.82 91.18 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.769 0.655 . . . . 3.07 112.769 -173.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.548 ' CZ ' ' HD2' ' A' ' 55' ' ' ARG . 61.7 m-85 -98.04 -3.26 38.45 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.175 -0.61 . . . . 1.01 112.514 -173.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.62 43.42 43.87 Favored Glycine 0 C--N 1.318 -0.425 0 C-N-CA 120.645 -0.788 . . . . 0.93 112.822 176.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.416 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 11.4 p -114.91 143.15 25.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 N-CA-C 109.421 -0.585 . . . . 1.16 109.421 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 m -99.74 120.35 39.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 109.126 -0.694 . . . . 1.87 109.126 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.1 mt -126.56 107.39 23.4 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 109.434 -0.58 . . . . 0.57 109.434 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.68 141.75 97.92 Favored 'Trans proline' 0 C--O 1.242 0.691 0 C-N-CA 122.324 2.016 . . . . 0.87 110.97 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -52.2 -39.84 60.72 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.432 1.093 . . . . 1.83 112.465 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.687 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 32.8 t70 -69.01 -38.81 79.45 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.58 -0.282 . . . . 2.34 110.88 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.6 t -69.97 -38.29 74.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.897 -0.779 . . . . 0.66 108.897 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -21.42 59.03 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.58 -0.736 . . . . 0.51 111.819 176.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.3 7.74 28.69 Favored Glycine 0 N--CA 1.442 -0.941 0 C-N-CA 121.162 -0.542 . . . . 0.61 112.219 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 24.3 mmm180 -101.31 -15.55 17.22 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.541 0.686 . . . . 3.98 109.958 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.579 HG23 HD21 ' A' ' 45' ' ' LEU . 30.9 m -78.07 101.39 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-O 122.456 1.122 . . . . 0.44 109.42 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.461 ' OD2' HG23 ' A' ' 70' ' ' THR . 8.5 t70 -88.2 -25.76 22.74 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.041 -1.436 . . . . 1.91 111.262 -177.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.461 HG23 ' OD2' ' A' ' 69' ' ' ASP . 30.1 p -133.62 147.39 64.39 Favored Pre-proline 0 N--CA 1.422 -1.838 0 CA-C-N 115.432 -0.804 . . . . 0.47 108.944 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.78 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 57.1 Cg_exo -55.7 -35.77 93.8 Favored 'Trans proline' 0 C--O 1.208 -0.98 0 C-N-CA 123.302 2.668 . . . . 0.32 112.037 177.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.579 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 9.8 ptm180 -54.33 -39.8 67.4 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 123.209 0.318 . . . . 1.48 111.615 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -67.33 -48.78 66.52 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 121.544 0.688 . . . . 2.13 110.693 174.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.529 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.35 -48.19 71.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.636 -1.165 . . . . 0.9 111.682 -174.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' ' 5' ' ' LEU . 31.3 tp -57.02 -47.53 80.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 123.027 0.531 . . . . 0.34 109.709 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.21 -43.18 96.17 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.055 -0.975 . . . . 0.57 111.303 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.42 -48.82 79.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.793 -0.639 . . . . 1.96 109.536 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.418 ' CD1' HD13 ' A' ' 52' ' ' LEU . 49.1 mt -65.76 -43.08 93.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 N-CA-C 110.359 -0.237 . . . . 0.55 110.359 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.06 -43.01 91.67 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 120.785 -0.366 . . . . 1.14 110.445 177.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.7 -40.05 93.83 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 116.056 -0.52 . . . . 0.53 112.301 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.18 71.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.076 0.465 . . . . 0.6 110.518 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.9 mt -70.3 -16.53 63.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.083 -0.508 . . . . 1.42 112.001 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.515 0 CA-C-O 120.865 0.364 . . . . 0.85 110.688 175.106 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.8 tp . . . . . 0 N--CA 1.389 -3.491 0 N-CA-C 109.393 -0.595 . . . . 1.51 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.445 ' O ' HD11 ' A' ' 75' ' ' LEU . 84.8 mt -106.74 126.36 52.2 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 108.901 -0.777 . . . . 0.8 108.901 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -93.42 -173.35 3.19 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.074 -1.454 . . . . 0.63 107.074 171.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.937 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.0 m -56.96 -47.14 81.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.087 -0.709 . . . . 0.61 109.087 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -58.74 -47.34 84.94 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.226 -0.897 . . . . 1.65 112.055 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -66.29 -32.29 73.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 120.652 -0.419 . . . . 1.41 110.489 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.411 HD11 ' CD1' ' A' ' 74' ' ' LEU . 17.8 tp -68.09 -46.73 70.18 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.807 -0.812 . . . . 0.48 108.807 178.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.579 ' O ' HG23 ' A' ' 15' ' ' VAL . 47.3 ttp180 -51.57 -48.39 63.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.791 -0.64 . . . . 2.46 110.574 176.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.491 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.7 ttm105 -53.39 -43.4 67.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 115.479 -0.782 . . . . 3.93 111.54 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.404 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -62.78 -40.76 98.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.032 0.444 . . . . 0.5 110.614 -179.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.46 HD12 HG21 ' A' ' 48' ' ' THR . 10.2 mp -65.95 -37.43 86.01 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.939 -0.573 . . . . 1.44 110.893 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 11' ' ' ARG . 16.5 t -71.47 -36.6 61.24 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 121.462 0.648 . . . . 0.8 109.398 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 60.3 mm-40 -64.04 -34.17 77.4 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.65 -0.657 . . . . 2.05 111.065 176.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 CA--C 1.559 1.312 0 CA-C-N 116.309 -0.405 . . . . 1.39 111.498 -177.895 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.937 ' HA ' HG21 ' A' ' 7' ' ' THR . 17.4 m-20 . . . . . 0 CA--C 1.487 -1.452 0 N-CA-C 109.821 -0.437 . . . . 2.07 109.821 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' HD13 ' A' ' 33' ' ' LEU . 18.1 p90 -112.88 9.91 18.96 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.547 -0.751 . . . . 0.44 109.98 179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.818 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 59.0 mt -52.93 -24.85 10.15 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.86 1.43 . . . . 0.39 114.86 -177.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -93.25 -19.94 20.91 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 120.819 0.342 . . . . 2.04 110.547 -176.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.5 mp -77.89 125.0 28.69 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 109.347 -0.612 . . . . 1.37 109.347 -176.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -74.85 135.61 41.58 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.743 -0.836 . . . . 3.94 108.743 -177.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -56.85 -46.65 81.6 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.354 0.409 . . . . 0.35 109.914 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -55.08 -28.54 53.18 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.156 0.982 . . . . 2.79 111.247 178.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -85.59 -32.83 21.88 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.812 -0.631 . . . . 0.88 111.873 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -96.26 30.4 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 113.836 1.051 . . . . 0.6 113.836 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.96 -16.78 60.6 Favored Glycine 0 C--N 1.316 -0.531 0 C-N-CA 120.587 -0.816 . . . . 0.66 113.521 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.439 ' CZ ' HD23 ' A' ' 14' ' ' LEU . 35.5 m-85 -81.61 163.93 22.22 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.718 0.771 . . . . 1.33 111.578 -177.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -135.46 140.84 45.17 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.088 -1.819 . . . . 1.06 106.088 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.486 ' O ' ' HG3' ' A' ' 46' ' ' MET . 57.6 p -48.45 -32.57 7.96 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 124.562 1.145 . . . . 1.03 113.641 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HA ' ' HE2' ' A' ' 46' ' ' MET . 6.1 tt -64.98 -50.63 65.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.482 -0.562 . . . . 1.56 109.482 177.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 -36.15 81.61 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.41 0.624 . . . . 0.43 110.293 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.545 HD21 HG23 ' A' ' 68' ' ' VAL . 61.0 tp -61.25 -37.15 82.05 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.83 -1.077 . . . . 0.43 110.54 179.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.0 mtm -63.1 -33.1 74.72 Favored 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 111.884 0.327 . . . . 1.49 111.884 178.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.66 -37.42 87.52 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.09 0.948 . . . . 1.88 109.468 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.46 HG21 HD12 ' A' ' 14' ' ' LEU . 31.2 m -66.94 -54.6 20.41 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.295 -1.321 . . . . 0.45 108.073 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.496 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.63 -34.81 69.71 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 114.916 -1.038 . . . . 0.27 110.044 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.94 -41.9 88.48 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 123.237 0.615 . . . . 0.33 111.322 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 mtp180 -64.93 -40.71 95.46 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 115.34 -0.845 . . . . 2.84 110.024 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.404 HD21 ' HB2' ' A' ' 13' ' ' ALA . 97.3 mt -63.96 -41.14 97.65 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.974 -0.557 . . . . 0.9 110.922 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.5 mt-10 -56.58 -55.0 39.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 123.686 0.616 . . . . 0.48 109.58 174.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -63.87 -42.44 97.51 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.097 -0.956 . . . . 1.19 111.757 -177.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -65.15 -51.91 58.35 Favored 'General case' 0 C--O 1.215 -0.725 0 C-N-CA 123.034 0.534 . . . . 3.07 111.636 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -93.68 -7.74 42.9 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 113.52 0.933 . . . . 1.01 113.52 -171.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.92 53.95 4.71 Favored Glycine 0 C--N 1.312 -0.793 0 C-N-CA 120.458 -0.877 . . . . 0.93 111.357 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.451 HG22 ' H ' ' A' ' 59' ' ' SER . 9.9 p -139.5 176.33 6.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.001 -1.111 . . . . 1.16 108.001 -177.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.451 ' H ' HG22 ' A' ' 58' ' ' VAL . 12.1 p -141.81 140.92 33.11 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 118.624 0.647 . . . . 1.87 110.422 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.496 HD12 ' HB1' ' A' ' 49' ' ' ALA . 61.2 mt -126.25 123.32 24.25 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.096 -1.076 . . . . 0.57 108.096 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.57 128.07 25.87 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.361 2.041 . . . . 0.87 110.1 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.66 -27.86 29.9 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.962 0.905 . . . . 1.83 113.355 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -67.2 -44.71 78.94 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.495 -0.557 . . . . 2.34 109.495 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.89 -41.94 60.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.852 -0.796 . . . . 0.66 108.852 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.98 -27.82 63.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.68 -0.691 . . . . 0.51 111.854 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.35 -1.51 47.49 Favored Glycine 0 N--CA 1.44 -1.087 0 C-N-CA 120.437 -0.887 . . . . 0.61 112.052 177.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -99.57 -10.55 21.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.295 0.569 . . . . 3.98 110.549 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.545 HG23 HD21 ' A' ' 45' ' ' LEU . 13.2 m -79.32 103.82 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.805 0 CA-C-O 121.582 0.706 . . . . 0.44 110.041 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.93 -40.36 14.88 Favored 'General case' 0 CA--C 1.482 -1.67 0 CA-C-N 115.523 -0.762 . . . . 1.91 110.862 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.1 p -107.86 133.03 20.62 Favored Pre-proline 0 N--CA 1.402 -2.865 0 CA-C-N 115.261 -0.881 . . . . 0.47 110.153 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.818 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.7 Cg_exo -50.71 -31.75 33.71 Favored 'Trans proline' 0 C--O 1.213 -0.755 0 C-N-CA 123.867 3.045 . . . . 0.32 113.285 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 11.5 ptp85 -52.94 -48.1 67.57 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 120.923 0.392 . . . . 1.48 110.781 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.412 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 10.5 mm-40 -66.15 -41.45 90.38 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 123.88 0.872 . . . . 2.13 110.651 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.544 HD23 HG21 ' A' ' 68' ' ' VAL . 3.0 tm? -68.26 -45.55 72.85 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.092 -0.958 . . . . 0.9 109.454 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 5' ' ' LEU . 32.3 tp -57.16 -51.9 67.45 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.724 -0.671 . . . . 0.34 109.392 178.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -56.65 -45.0 81.86 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.044 0.938 . . . . 0.57 112.1 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.39 -49.33 77.32 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.296 -0.631 . . . . 1.96 109.296 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.455 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 61.6 mt -66.88 -45.21 88.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 116.168 -0.469 . . . . 0.55 110.396 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -45.95 71.77 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.563 0.345 . . . . 1.14 110.671 177.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.6 -42.56 97.31 Favored Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.887 -0.597 . . . . 0.53 112.377 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.62 -38.28 80.42 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.323 0.249 . . . . 0.6 110.818 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 80.3 mt -60.79 -46.18 91.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.385 0.612 . . . . 1.42 110.28 177.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.871 0 CA-C-N 115.672 -0.695 . . . . 0.85 111.548 177.733 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 tp . . . . . 0 N--CA 1.421 -1.885 0 CA-C-O 121.64 0.734 . . . . 1.51 112.075 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.08 127.07 35.99 Favored 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 114.865 -1.061 . . . . 0.8 109.827 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -101.2 179.82 4.26 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 107.07 -1.455 . . . . 0.63 107.07 170.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.885 HG21 ' HA ' ' A' ' 29' ' ' ASP . 19.4 m -58.29 -40.88 83.14 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.413 0.625 . . . . 0.61 109.594 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.39 -53.7 55.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 114.747 -1.115 . . . . 1.65 111.237 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 12' ' ' ARG . 8.5 t70 -69.6 -33.23 72.39 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 121.293 0.568 . . . . 1.41 110.395 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.493 HD11 HD12 ' A' ' 74' ' ' LEU . 17.8 tp -65.32 -45.89 82.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.158 -0.682 . . . . 0.48 109.158 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 15' ' ' VAL . 45.4 ttp180 -54.25 -43.91 71.34 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 123.937 0.895 . . . . 2.46 109.978 176.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 53.6 ttt180 -54.84 -45.82 74.54 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 115.163 -0.926 . . . . 3.93 110.726 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.478 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -61.05 -40.65 94.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.094 -0.503 . . . . 0.5 111.148 -178.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -64.78 -44.2 90.74 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 121.105 -0.238 . . . . 1.44 111.201 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 11' ' ' ARG . 60.6 t -63.19 -47.95 89.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.284 -0.416 . . . . 0.8 110.019 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.04 -32.17 73.47 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.832 0.308 . . . . 2.05 111.832 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.497 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 35.7 t . . . . . 0 C--N 1.313 -0.989 0 CA-C-O 120.773 0.321 . . . . 1.39 111.395 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.885 ' HA ' HG21 ' A' ' 7' ' ' THR . 4.2 m-20 . . . . . 0 CA--C 1.49 -1.359 0 CA-C-O 121.319 0.581 . . . . 2.07 110.638 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.447 ' HA ' HD23 ' A' ' 33' ' ' LEU . 21.7 p90 -95.35 13.26 26.31 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.391 -0.822 . . . . 0.44 110.144 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.725 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 58.6 mt -50.82 -23.95 3.14 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.82 1.785 . . . . 0.39 115.82 -175.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.98 -8.93 32.39 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.39 0.614 . . . . 2.04 111.414 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 30' ' ' PHE . 3.9 mm? -79.12 123.72 27.63 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.612 -0.514 . . . . 1.37 109.612 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -75.48 141.52 43.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.175 -1.046 . . . . 3.94 108.175 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.6 m-85 -59.99 -41.38 91.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 110.278 -0.268 . . . . 0.35 110.278 -178.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -57.76 -27.37 62.99 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.355 0.597 . . . . 2.79 111.344 176.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -84.79 -33.96 22.88 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.094 0.473 . . . . 0.88 110.895 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 27.2 pt -93.15 16.91 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.634 0.605 . . . . 0.6 112.634 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.79 43.18 18.84 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 116.059 -0.519 . . . . 0.66 113.411 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.423 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 15.2 m-85 -126.93 117.09 21.84 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 122.684 -0.304 . . . . 1.33 111.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.43 151.85 24.39 Favored 'General case' 0 CA--C 1.474 -1.956 0 N-CA-C 108.269 -1.011 . . . . 1.06 108.269 171.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.466 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 15.7 p -53.45 -30.35 40.15 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.616 0.969 . . . . 1.03 113.616 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.76 -54.59 36.84 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.625 -0.88 . . . . 1.56 108.625 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.06 80.16 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.053 0.541 . . . . 0.43 111.064 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.516 ' O ' ' HB ' ' A' ' 48' ' ' THR . 65.0 tp -64.3 -41.07 97.04 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.907 -0.588 . . . . 0.43 110.912 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 71.4 mtm -64.28 -31.73 73.05 Favored 'General case' 0 C--O 1.196 -1.723 0 O-C-N 122.026 -0.422 . . . . 1.49 111.541 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 9.3 tp10 -63.58 -33.03 74.7 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.731 0.777 . . . . 1.88 109.237 174.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 39.7 m -66.4 -55.32 16.36 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.398 -1.334 . . . . 0.45 107.398 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.06 -39.69 75.41 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-N 114.345 -1.298 . . . . 0.27 109.888 175.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.25 -45.98 86.79 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 123.775 0.83 . . . . 0.33 111.95 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 56.4 mtt180 -65.03 -37.15 86.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.707 -0.679 . . . . 2.84 109.908 178.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 13' ' ' ALA . 81.3 mt -65.59 -38.94 90.93 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 116.049 -0.523 . . . . 0.9 111.039 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.6 mt-10 -56.6 -55.08 38.5 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.626 0.579 . . . . 0.48 109.482 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 m -62.07 -40.61 96.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.518 -0.764 . . . . 1.19 112.136 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -66.09 -49.46 67.52 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.124 -0.489 . . . . 3.07 112.14 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -98.51 -11.16 22.54 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.947 1.462 . . . . 1.01 114.947 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.74 53.08 6.66 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.415 -0.898 . . . . 0.93 111.188 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.6 p -135.24 137.49 50.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 0 N-CA-C 108.448 -0.945 . . . . 1.16 108.448 -177.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.4 m -96.57 114.54 26.21 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 120.722 0.296 . . . . 1.87 110.7 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.2 mt -104.62 122.24 44.28 Favored Pre-proline 0 C--N 1.32 -0.695 0 C-N-CA 122.931 0.492 . . . . 0.57 109.969 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -67.78 131.73 24.95 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.956 2.437 . . . . 0.87 112.07 178.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -52.06 -40.51 61.26 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.848 1.259 . . . . 1.83 113.742 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.44 -37.85 83.63 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.901 -0.32 . . . . 2.34 110.533 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 34.0 t -75.23 -42.01 44.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.891 -0.781 . . . . 0.66 108.891 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.88 -32.05 69.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.603 -0.726 . . . . 0.51 111.386 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.87 9.68 63.97 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.73 -0.748 . . . . 0.61 112.273 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -100.41 -24.13 14.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.952 0.406 . . . . 3.98 110.292 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.536 HG21 HD23 ' A' ' 74' ' ' LEU . 20.8 m -75.68 103.88 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 CA-C-O 122.029 0.918 . . . . 0.44 111.032 -177.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.74 -30.32 20.4 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-N 115.132 -0.94 . . . . 1.91 111.488 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.4 p -122.51 145.53 45.04 Favored Pre-proline 0 N--CA 1.419 -1.981 0 CA-C-N 115.946 -0.57 . . . . 0.47 109.836 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.725 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.4 Cg_exo -53.07 -40.73 75.77 Favored 'Trans proline' 0 CA--C 1.509 -0.773 0 C-N-CA 124.023 3.148 . . . . 0.32 114.024 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.9 ptp85 -52.36 -39.78 61.17 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 123.495 0.497 . . . . 1.48 111.663 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.22 -51.55 63.15 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.933 -0.576 . . . . 2.13 109.837 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.536 HD23 HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -67.34 -39.76 85.83 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.619 -1.173 . . . . 0.9 110.213 -176.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.433 HD13 HD22 ' A' ' 10' ' ' LEU . 48.0 tp -56.91 -57.67 11.5 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 109.219 -0.659 . . . . 0.34 109.219 177.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.87 -37.86 74.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 123.766 0.666 . . . . 0.57 111.438 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -59.57 -53.08 62.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.682 -0.69 . . . . 1.96 110.439 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.465 HG22 HD13 ' A' ' 82' ' ' LEU . 44.9 mt -76.08 -21.92 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 C-N-CA 120.364 -0.534 . . . . 0.55 110.53 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -64.83 -50.29 67.28 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.853 -0.795 . . . . 1.14 108.853 173.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.66 -38.24 95.41 Favored Glycine 0 N--CA 1.439 -1.125 0 CA-C-N 115.249 -0.887 . . . . 0.53 111.668 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.75 -39.11 84.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.433 0.159 . . . . 0.6 110.845 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.465 HD13 HG22 ' A' ' 78' ' ' ILE . 5.3 mp -70.86 -39.01 73.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 122.357 0.263 . . . . 1.42 111.4 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.479 0 CA-C-O 121.567 0.698 . . . . 0.85 110.019 175.582 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.522 ' HA ' ' HG ' ' A' ' 82' ' ' LEU . 22.6 tp . . . . . 0 N--CA 1.418 -2.034 0 N-CA-C 103.616 -2.735 . . . . 1.51 103.616 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.546 HD11 HD22 ' A' ' 52' ' ' LEU . 94.9 mt -117.35 124.22 48.39 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 108.157 -1.053 . . . . 0.8 108.157 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.9 p -97.6 -171.38 2.17 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 107.836 -1.172 . . . . 0.63 107.836 170.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.1 m -52.25 -54.98 24.33 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 123.891 0.876 . . . . 0.61 111.436 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.444 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . 32.1 t70 -72.07 -28.13 63.13 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 112.713 0.634 . . . . 1.65 112.713 -178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.47 -44.98 85.45 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.573 -0.899 . . . . 1.41 108.573 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 30.9 tp -65.68 -47.39 75.63 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.626 -1.17 . . . . 0.48 108.881 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 36.7 ttt-85 -49.54 -51.51 36.13 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.343 1.057 . . . . 2.46 110.963 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 65.6 ttt180 -59.08 -50.58 73.54 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.435 -0.348 . . . . 3.93 111.581 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.26 -36.22 77.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.13 -0.486 . . . . 0.5 111.323 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.624 HD23 HG21 ' A' ' 48' ' ' THR . 99.1 mt -63.34 -53.52 51.37 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.523 0.514 . . . . 1.44 110.169 177.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 94.6 t -57.97 -45.92 87.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.949 -0.569 . . . . 0.8 111.355 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.624 ' HB2' HH12 ' A' ' 51' ' ' ARG . 55.6 mt-10 -60.87 -30.46 70.15 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.503 -0.317 . . . . 2.05 111.723 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 C--N 1.319 -0.724 0 C-N-CA 121.128 -0.229 . . . . 1.39 111.428 -176.435 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 CA--C 1.502 -0.895 0 N-CA-C 109.264 -0.643 . . . . 2.07 109.264 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -100.36 3.66 43.43 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.921 -0.77 . . . . 0.44 108.921 176.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.692 HD13 ' HB3' ' A' ' 72' ' ' ARG . 41.4 mt -54.2 -26.68 29.59 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.541 1.136 . . . . 0.39 113.99 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -90.32 -19.31 24.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.733 0.778 . . . . 2.04 110.445 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -81.96 123.71 29.12 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.317 -0.994 . . . . 1.37 108.317 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.63 146.0 42.79 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 116.278 -0.419 . . . . 3.94 110.292 -176.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.543 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 70.2 m-85 -61.94 -32.91 73.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.342 0.591 . . . . 0.35 109.543 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -54.72 -40.68 69.48 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.739 -1.119 . . . . 2.79 110.182 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -81.1 -33.34 33.39 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.941 -1.027 . . . . 0.88 111.06 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.5 pt -92.14 19.55 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 112.26 0.467 . . . . 0.6 112.26 -177.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 69.34 46.33 57.15 Favored Glycine 0 CA--C 1.511 -0.177 0 CA-C-N 116.122 -0.49 . . . . 0.66 113.626 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.543 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 7.7 m-85 -118.86 124.89 48.25 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 120.724 0.297 . . . . 1.33 111.502 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -84.7 134.1 34.36 Favored 'General case' 0 CA--C 1.484 -1.572 0 N-CA-C 107.709 -1.219 . . . . 1.06 107.709 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.505 ' O ' ' HB3' ' A' ' 45' ' ' LEU . 15.9 m -53.63 -26.12 20.72 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 123.607 0.567 . . . . 1.03 111.418 174.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.7 tp -64.7 -49.89 69.13 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.78 -0.575 . . . . 1.56 110.099 174.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.86 73.28 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 122.128 0.966 . . . . 0.43 109.702 177.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.624 HD21 HG23 ' A' ' 68' ' ' VAL . 33.8 tp -62.77 -50.64 70.23 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.49 -1.232 . . . . 0.43 108.957 176.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.9 mtp -62.56 -33.29 74.66 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.264 -0.425 . . . . 1.49 110.823 176.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.71 -36.59 81.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 122.159 0.981 . . . . 1.88 108.757 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.624 HG21 HD23 ' A' ' 14' ' ' LEU . 89.3 m -68.57 -57.65 5.44 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.245 -1.391 . . . . 0.45 107.245 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.619 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -54.82 -33.02 61.08 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.908 -1.496 . . . . 0.27 111.07 178.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.65 -46.92 83.57 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.154 0.502 . . . . 0.33 111.567 178.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.624 HH12 ' HB2' ' A' ' 16' ' ' GLU . 66.7 mtp180 -64.07 -37.79 88.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.307 -0.861 . . . . 2.84 109.634 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.619 HD12 ' HA ' ' A' ' 49' ' ' ALA . 65.1 mt -66.14 -47.97 72.31 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.9 110.295 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.9 mt-10 -58.43 -40.58 82.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.903 0.383 . . . . 0.48 110.246 175.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.8 t -61.26 -64.39 0.97 Allowed 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.203 -0.908 . . . . 1.19 111.005 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -63.86 -41.67 97.72 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.354 0.872 . . . . 3.07 113.354 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -93.2 -4.5 51.9 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 112.999 0.741 . . . . 1.01 112.999 -171.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.86 26.06 72.07 Favored Glycine 0 C--O 1.239 0.456 0 C-N-CA 120.981 -0.628 . . . . 0.93 112.562 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.777 HG11 HD22 ' A' ' 82' ' ' LEU . 28.9 m -99.15 173.96 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.937 -0.132 . . . . 1.16 110.749 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.2 p -141.9 113.68 7.91 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-O 121.421 0.629 . . . . 1.87 112.05 -176.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.488 HD12 ' HB1' ' A' ' 49' ' ' ALA . 63.4 mt -103.92 127.29 29.65 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 108.509 -0.923 . . . . 0.57 108.509 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.72 136.66 68.04 Favored 'Trans proline' 0 C--O 1.242 0.681 0 C-N-CA 122.37 2.047 . . . . 0.87 110.645 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -52.72 -41.87 64.35 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.902 0.704 . . . . 1.83 112.902 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.28 -32.51 72.72 Favored 'General case' 0 C--O 1.183 -2.429 0 CA-C-N 116.481 -0.327 . . . . 2.34 110.447 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.6 -44.74 46.6 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 N-CA-C 109.093 -0.706 . . . . 0.66 109.093 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.04 -35.37 66.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.531 0.732 . . . . 0.51 112.516 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.54 23.08 27.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.538 -0.839 . . . . 0.61 112.967 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -134.87 -0.28 2.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.8 0.81 . . . . 3.98 110.451 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.624 HG23 HD21 ' A' ' 45' ' ' LEU . 6.3 m -78.5 101.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.268 -1.012 . . . . 0.44 108.268 173.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -89.96 -30.52 17.75 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 114.49 -1.232 . . . . 1.91 110.295 -173.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.4 p -114.85 130.61 24.01 Favored Pre-proline 0 N--CA 1.403 -2.788 0 CA-C-N 115.085 -0.962 . . . . 0.47 109.914 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.645 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 86.4 Cg_exo -47.91 -46.74 20.85 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.095 3.197 . . . . 0.32 113.738 -175.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.692 ' HB3' HD13 ' A' ' 31' ' ' LEU . 18.2 ptt180 -54.33 -37.28 64.69 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 114.155 1.169 . . . . 1.48 114.155 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -66.54 -43.56 84.8 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.159 0.504 . . . . 2.13 110.976 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.486 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 3.2 tm? -69.22 -45.07 70.73 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.203 -0.908 . . . . 0.9 109.398 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.6 tp -56.31 -49.79 73.3 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 123.454 0.702 . . . . 0.34 109.411 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -57.23 -46.11 83.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.166 -0.925 . . . . 0.57 111.503 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -61.05 -47.12 87.83 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.241 -0.651 . . . . 1.96 109.241 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.492 HG21 HD12 ' A' ' 5' ' ' LEU . 58.3 mt -70.3 -27.98 33.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.795 0.331 . . . . 0.55 111.563 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -39.23 83.91 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 121.922 -0.486 . . . . 1.14 110.032 174.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.51 -39.58 91.09 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.772 -0.931 . . . . 0.53 110.772 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.28 87.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.677 0.275 . . . . 0.6 110.503 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.777 HD22 HG11 ' A' ' 58' ' ' VAL . 4.0 mm? -69.74 -27.57 65.06 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 111.878 0.325 . . . . 1.42 111.878 176.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.748 0 CA-C-O 121.471 0.653 . . . . 0.85 109.483 174.814 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB3' ' OD1' ' A' ' 79' ' ' ASN . 9.1 mp . . . . . 0 N--CA 1.44 -0.945 0 CA-C-O 121.819 0.819 . . . . 1.51 112.218 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.463 HD11 ' CD1' ' A' ' 52' ' ' LEU . 38.6 mt -96.05 142.69 27.95 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.16 -0.927 . . . . 0.8 112.329 -167.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.8 p -101.99 -178.15 3.62 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.451 -1.685 . . . . 0.63 106.451 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.866 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.4 m -59.88 -32.92 71.17 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.315 0.578 . . . . 0.61 110.081 175.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.588 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 15.7 t70 -67.82 -42.76 81.0 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.627 -0.715 . . . . 1.65 110.043 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.419 ' HB3' HD22 ' A' ' 5' ' ' LEU . 6.9 m-20 -63.92 -38.29 90.53 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.55 -0.75 . . . . 1.41 109.476 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.4 tp -66.32 -45.68 79.46 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.182 -0.917 . . . . 0.48 109.844 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttp180 -52.41 -46.27 66.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.762 0.425 . . . . 2.46 111.024 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 94.4 mtt180 -54.66 -50.1 69.0 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.531 -0.759 . . . . 3.93 110.187 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.15 87.32 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.402 -0.817 . . . . 0.5 111.841 -175.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.02 -45.74 80.41 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.159 -0.216 . . . . 1.44 110.667 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.3 t -57.09 -40.33 72.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.151 0.5 . . . . 0.8 110.052 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 70.1 mm-40 -60.53 -40.08 90.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.741 -0.663 . . . . 2.05 111.408 177.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--N 1.31 -1.145 0 CA-C-N 115.492 -0.776 . . . . 1.39 112.162 -174.195 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.866 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.4 t70 . . . . . 0 N--CA 1.43 -1.44 0 N-CA-C 109.104 -0.702 . . . . 2.07 109.104 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.463 ' HA ' HD23 ' A' ' 33' ' ' LEU . 28.2 p90 -105.4 19.4 20.64 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 116.049 -0.523 . . . . 0.44 111.161 -177.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.857 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 57.9 mt -52.19 -22.9 4.75 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.95 1.463 . . . . 0.39 114.95 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.97 -20.42 19.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.654 0.264 . . . . 2.04 111.513 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 30' ' ' PHE . 3.4 mm? -78.48 114.1 17.09 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-O 121.453 0.644 . . . . 1.37 109.587 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.596 ' HG2' HG22 ' A' ' 70' ' ' THR . 40.1 mtt180 -76.35 144.04 40.39 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.718 -1.128 . . . . 3.94 109.978 -172.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.597 ' HA ' HG12 ' A' ' 38' ' ' ILE . 44.1 m-85 -61.78 -41.9 98.3 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.369 -0.378 . . . . 0.35 110.993 -174.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -37.5 70.43 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.725 0.774 . . . . 2.79 110.338 176.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -81.09 -23.59 38.32 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.247 -0.888 . . . . 0.88 110.963 -174.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.597 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.2 pt -98.22 15.55 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.408 0.623 . . . . 0.6 111.788 177.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.32 36.9 38.06 Favored Glycine 0 C--O 1.226 -0.377 0 CA-C-N 115.823 -0.626 . . . . 0.66 113.967 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -113.0 127.58 56.27 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 122.305 -0.527 . . . . 1.33 111.356 177.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -86.05 145.37 27.1 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 106.304 -1.739 . . . . 1.06 106.304 172.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 46' ' ' MET . 34.1 p -52.55 -31.37 35.5 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 113.275 0.843 . . . . 1.03 113.275 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.69 -43.16 90.09 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.007 0.432 . . . . 1.56 110.108 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.415 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -64.32 -36.38 83.94 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 121.375 0.607 . . . . 0.43 109.392 175.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.556 ' O ' ' HB ' ' A' ' 48' ' ' THR . 50.6 tp -66.39 -40.14 89.49 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.3 -0.863 . . . . 0.43 111.621 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.533 ' HG3' ' O ' ' A' ' 42' ' ' SER . 60.6 mtt -64.5 -30.19 71.23 Favored 'General case' 0 C--O 1.207 -1.141 0 O-C-N 121.714 -0.616 . . . . 1.49 110.444 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 7.7 tp10 -61.65 -33.59 74.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 122.282 1.039 . . . . 1.88 108.742 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.556 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 55.8 m -67.92 -61.65 1.77 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.583 -1.644 . . . . 0.45 107.362 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -54.05 -34.54 60.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.319 -1.309 . . . . 0.27 111.026 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.15 -49.72 73.17 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 123.651 0.78 . . . . 0.33 111.896 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HA ' ' OG ' ' A' ' 54' ' ' SER . 92.8 mtt180 -67.3 -30.48 70.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.821 -0.627 . . . . 2.84 111.375 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 48' ' ' THR . 3.9 mm? -64.53 -46.59 82.23 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.47 -0.332 . . . . 0.9 110.198 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.582 ' HA ' HG12 ' A' ' 58' ' ' VAL . 44.4 mt-10 -57.09 -51.38 69.53 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 115.562 -0.745 . . . . 0.48 110.358 177.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.431 ' OG ' ' HA ' ' A' ' 51' ' ' ARG . 6.4 p -63.45 -52.46 61.34 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.501 0.926 . . . . 1.19 113.501 -178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.483 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 30.3 ttm180 -66.46 -49.84 65.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.809 0.67 . . . . 3.07 112.809 -177.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.483 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 99.6 m-85 -92.56 -17.36 24.53 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.056 0.762 . . . . 1.01 113.056 -170.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.15 68.14 1.44 Allowed Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.243 -0.979 . . . . 0.93 110.945 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 53' ' ' GLU . 10.8 p -141.61 176.1 4.64 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 N-CA-C 108.066 -1.087 . . . . 1.16 108.066 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.501 ' H ' HG22 ' A' ' 58' ' ' VAL . 4.4 p -140.68 107.36 5.35 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.345 0.593 . . . . 1.87 109.996 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.445 HD12 ' HB1' ' A' ' 49' ' ' ALA . 61.6 mt -105.99 111.81 64.38 Favored Pre-proline 0 C--N 1.31 -1.109 0 CA-C-N 115.227 -0.897 . . . . 0.57 109.197 -176.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -59.58 130.13 34.06 Favored 'Trans proline' 0 C--O 1.25 1.076 0 C-N-CA 122.629 2.22 . . . . 0.87 111.515 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -51.18 -39.46 56.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.306 1.442 . . . . 1.83 111.961 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.42 -39.02 85.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.496 -0.32 . . . . 2.34 111.292 -177.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.22 -39.54 42.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 109.041 -0.726 . . . . 0.66 109.041 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -36.69 73.88 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.904 -0.589 . . . . 0.51 111.096 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -88.65 4.83 85.08 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.015 -0.612 . . . . 0.61 112.349 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -102.78 -25.21 13.6 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 122.779 -0.248 . . . . 3.98 111.271 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 m -72.71 105.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.835 0.826 . . . . 0.44 109.933 -178.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.441 ' OD2' ' HD3' ' A' ' 34' ' ' ARG . 34.1 t70 -87.44 -24.28 24.21 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 114.722 -1.126 . . . . 1.91 110.807 -176.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.596 HG22 ' HG2' ' A' ' 34' ' ' ARG . 31.9 p -123.96 138.93 31.44 Favored Pre-proline 0 N--CA 1.418 -2.053 0 CA-C-N 115.685 -0.689 . . . . 0.47 110.705 -178.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.857 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.2 Cg_exo -54.73 -34.16 83.23 Favored 'Trans proline' 0 CA--C 1.514 -0.509 0 C-N-CA 123.669 2.913 . . . . 0.32 112.812 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.414 ' HG2' ' HB ' ' A' ' 70' ' ' THR . 3.9 ptp180 -51.8 -45.21 63.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 123.413 0.446 . . . . 1.48 111.966 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.38 -45.32 88.19 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 121.29 0.567 . . . . 2.13 110.483 178.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.05 -46.2 75.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.328 -0.851 . . . . 0.9 109.88 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.42 -46.08 83.93 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 116.216 -0.447 . . . . 0.34 109.803 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.11 -43.34 98.7 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.189 -0.914 . . . . 0.57 110.546 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.58 -52.28 66.08 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 123.568 0.747 . . . . 1.96 111.301 -177.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.7 mt -68.2 -46.62 80.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.558 0 C-N-CA 120.234 -0.586 . . . . 0.55 110.62 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.442 ' OD1' ' HB3' ' A' ' 4' ' ' LEU . 17.1 m-80 -55.99 -42.54 76.51 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 120.61 0.243 . . . . 1.14 110.575 177.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.12 -46.38 65.69 Favored Glycine 0 C--N 1.321 -0.304 0 CA-C-N 116.303 -0.408 . . . . 0.53 112.624 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.24 -35.91 80.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.705 0.288 . . . . 0.6 110.565 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.06 -39.45 79.12 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.376 -0.374 . . . . 1.42 111.138 176.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 116.233 -0.44 . . . . 0.85 110.669 177.816 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 79' ' ' ASN . 25.7 tp . . . . . 0 N--CA 1.398 -3.031 0 CA-C-O 121.093 0.473 . . . . 1.51 109.805 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.7 mt -92.52 128.48 38.39 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-N 115.855 -0.611 . . . . 0.8 111.051 -176.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.6 p -97.8 -176.35 3.44 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.409 -1.7 . . . . 0.63 106.409 168.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.4 m -57.81 -36.19 71.88 Favored 'General case' 0 C--N 1.312 -1.022 0 O-C-N 123.039 0.212 . . . . 0.61 110.626 174.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 11' ' ' ARG . 25.6 t70 -78.53 -32.71 48.09 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.076 0.465 . . . . 1.65 111.069 -177.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.46 -42.78 87.07 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.97 -0.752 . . . . 1.41 108.97 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.697 HD11 HD22 ' A' ' 74' ' ' LEU . 13.9 tp -66.54 -41.69 88.34 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.729 -1.123 . . . . 0.48 108.667 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 8' ' ' ASP . 72.6 ttt180 -48.32 -58.48 4.53 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.203 1.401 . . . . 2.46 111.601 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.54 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 62.3 mtp180 -58.18 -36.44 73.06 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 112.498 0.555 . . . . 3.93 112.498 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -45.2 95.3 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 123.377 0.423 . . . . 0.5 109.905 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.93 -42.36 90.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.344 -0.389 . . . . 1.44 111.799 177.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 11' ' ' ARG . 90.6 t -54.54 -51.71 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 121.029 0.442 . . . . 0.8 110.221 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 13.7 mm-40 -63.72 -32.61 74.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.505 -0.77 . . . . 2.05 112.522 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p . . . . . 0 C--N 1.317 -0.836 0 N-CA-C 112.745 0.646 . . . . 1.39 112.745 -175.544 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 . . . . . 0 CA--C 1.499 -0.994 0 N-CA-C 109.925 -0.398 . . . . 2.07 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' A' ' 33' ' ' LEU . 14.0 p90 -136.4 15.16 3.21 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.261 0.553 . . . . 0.44 110.075 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.644 HD23 ' HB2' ' A' ' 71' ' ' PRO . 60.1 mt -53.48 -24.16 12.25 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.183 1.549 . . . . 0.39 115.183 -177.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -95.36 -3.34 47.35 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.387 0.514 . . . . 2.04 112.387 -178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.498 ' O ' ' HD3' ' A' ' 71' ' ' PRO . 8.9 mp -80.63 138.81 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.394 -0.367 . . . . 1.37 110.698 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.11 141.37 35.83 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 109.785 -0.45 . . . . 3.94 109.785 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.433 ' HA ' HG12 ' A' ' 38' ' ' ILE . 50.4 m-85 -68.27 -42.91 78.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.362 0.601 . . . . 0.35 109.468 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.537 ' CD ' ' H ' ' A' ' 36' ' ' GLU . 1.5 mp0 -54.67 -34.96 63.04 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 124.655 1.182 . . . . 2.79 109.921 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -79.32 -31.39 43.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.564 -1.198 . . . . 0.88 111.124 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.54 HG13 ' CD1' ' A' ' 40' ' ' TYR . 31.0 pt -93.21 15.78 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 120.485 -0.486 . . . . 0.6 111.572 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.19 34.36 17.76 Favored Glycine 0 C--O 1.238 0.382 0 CA-C-N 115.732 -0.667 . . . . 0.66 114.127 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.54 ' CD1' HG13 ' A' ' 38' ' ' ILE . 9.1 m-85 -116.45 123.16 46.82 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 122.598 -0.354 . . . . 1.33 111.264 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.09 151.16 24.35 Favored 'General case' 0 CA--C 1.48 -1.726 0 N-CA-C 106.439 -1.689 . . . . 1.06 106.439 171.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.3 p -53.51 -34.63 58.81 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 113.076 0.769 . . . . 1.03 113.076 179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.71 -45.95 77.1 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 109.307 -0.627 . . . . 1.56 109.307 177.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.78 94.9 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.474 0.654 . . . . 0.43 109.846 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.606 HD21 HG23 ' A' ' 68' ' ' VAL . 56.7 tp -62.19 -40.16 95.15 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.686 -1.143 . . . . 0.43 110.175 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 81.9 mtp -63.99 -33.15 75.09 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.213 -0.449 . . . . 1.49 111.489 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.91 -29.3 70.23 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.492 0.663 . . . . 1.88 109.995 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 24.7 m -64.8 -61.86 1.92 Allowed 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.912 -1.514 . . . . 0.45 106.912 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.2 -36.06 70.39 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.776 -1.556 . . . . 0.27 110.655 177.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.5 -45.9 87.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.19 0.596 . . . . 0.33 111.96 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.53 -37.52 86.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.852 -0.613 . . . . 2.84 110.222 177.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 96.7 mt -64.38 -43.08 95.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.194 -0.457 . . . . 0.9 110.667 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 40.4 mt-10 -57.0 -54.05 51.16 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 109.936 -0.394 . . . . 0.48 109.936 175.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.4 m -61.55 -39.7 92.05 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.912 -1.04 . . . . 1.19 111.783 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.505 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 32.1 ttm180 -67.53 -50.55 58.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.27 -0.423 . . . . 3.07 111.733 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.505 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 89.9 m-85 -96.92 -22.91 16.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.691 1.367 . . . . 1.01 114.691 -171.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.63 21.66 33.58 Favored Glycine 0 C--N 1.306 -1.113 0 C-N-CA 119.937 -1.125 . . . . 0.93 112.461 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.02 137.41 26.55 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 N-CA-C 108.645 -0.872 . . . . 1.16 108.645 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.0 m -98.34 113.23 25.13 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.044 0.449 . . . . 1.87 110.866 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.6 mt -99.35 125.24 41.94 Favored Pre-proline 0 C--N 1.31 -1.125 0 CA-C-N 116.251 -0.432 . . . . 0.57 110.026 -178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.415 ' HB2' HG23 ' A' ' 64' ' ' VAL . 36.5 Cg_exo -62.77 116.01 3.28 Favored 'Trans proline' 0 C--O 1.243 0.74 0 C-N-CA 122.2 1.933 . . . . 0.87 110.044 175.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -55.24 -24.25 26.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.92 0.888 . . . . 1.83 113.059 -177.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.84 -43.94 74.47 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.175 0.512 . . . . 2.34 110.007 176.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 61' ' ' PRO . 32.6 t -74.55 -34.71 36.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 109.142 -0.688 . . . . 0.66 109.142 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.7 -24.5 61.52 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.726 -0.67 . . . . 0.51 111.976 178.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -0.11 48.36 Favored Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.548 -0.834 . . . . 0.61 112.449 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -100.62 -12.81 18.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.184 0.516 . . . . 3.98 110.606 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.606 HG23 HD21 ' A' ' 45' ' ' LEU . 19.0 m -74.04 115.96 15.84 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.296 0 CA-C-O 121.635 0.731 . . . . 0.44 110.576 -177.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.98 -49.85 6.53 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 114.637 -1.165 . . . . 1.91 109.701 -176.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.528 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 26.5 p -118.15 157.31 49.18 Favored Pre-proline 0 N--CA 1.406 -2.671 0 CA-C-N 114.775 -1.102 . . . . 0.47 109.314 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.644 ' HB2' HD23 ' A' ' 31' ' ' LEU . 49.2 Cg_exo -58.49 -27.28 81.59 Favored 'Trans proline' 0 CA--C 1.5 -1.202 0 C-N-CA 123.591 2.861 . . . . 0.32 112.657 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -52.97 -48.64 67.27 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.602 0.564 . . . . 1.48 110.002 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.68 -47.61 80.53 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 114.626 -1.17 . . . . 2.13 109.828 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -67.19 -50.27 61.6 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.853 -1.067 . . . . 0.9 110.144 -175.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' A' ' 79' ' ' ASN . 59.7 tp -55.85 -52.1 65.2 Favored 'General case' 0 C--O 1.206 -1.198 0 O-C-N 123.61 0.569 . . . . 0.34 110.389 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.04 -37.3 82.13 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 123.69 0.619 . . . . 0.57 112.03 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.98 -52.27 64.68 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.314 -0.403 . . . . 1.96 109.945 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.7 mt -70.67 -44.49 76.51 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.902 0 C-N-CA 120.223 -0.591 . . . . 0.55 109.932 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.48 ' HA ' HD11 ' A' ' 4' ' ' LEU . 6.7 t-20 -49.52 -53.59 22.62 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 123.735 0.814 . . . . 1.14 110.755 -175.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.84 94.67 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.985 -0.626 . . . . 0.53 112.696 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.72 -33.94 73.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.12 0.486 . . . . 0.6 111.607 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.414 HD23 HD12 ' A' ' 4' ' ' LEU . 26.3 tp -78.68 -31.91 46.86 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 123.835 0.854 . . . . 1.42 110.051 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-O 121.569 0.7 . . . . 0.85 109.764 173.974 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.501 HD11 ' HA ' ' A' ' 79' ' ' ASN . 46.4 tp . . . . . 0 N--CA 1.402 -2.848 0 N-CA-C 107.326 -1.361 . . . . 1.51 107.326 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.405 HD11 HD22 ' A' ' 52' ' ' LEU . 96.0 mt -84.11 122.45 28.83 Favored 'General case' 0 C--N 1.289 -2.056 0 C-N-CA 120.422 -0.511 . . . . 0.8 109.8 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.4 p -102.1 -173.92 2.45 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.239 -1.393 . . . . 0.63 107.239 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.9 m -58.36 -43.3 88.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.75 -0.833 . . . . 0.61 108.75 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.9 -47.1 87.96 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.76 -1.109 . . . . 1.65 110.943 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.27 -39.02 89.14 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 116.091 -0.504 . . . . 1.41 110.771 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.436 HD11 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -66.03 -41.59 90.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 0.48 110.02 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -53.31 -54.73 32.19 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.878 0.871 . . . . 2.46 109.634 175.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -58.72 -38.85 79.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.491 -1.231 . . . . 3.93 111.42 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.96 82.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.08 -0.509 . . . . 0.5 111.536 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.74 HD23 HG21 ' A' ' 48' ' ' THR . 94.8 mt -63.67 -44.58 93.32 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.219 0.533 . . . . 1.44 109.97 178.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.0 t -62.77 -50.62 79.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.395 -0.82 . . . . 0.8 109.103 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -59.72 -25.05 64.5 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 2.05 113.167 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.631 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 27.5 m . . . . . 0 C--N 1.301 -1.537 0 CA-C-O 120.81 0.338 . . . . 1.39 111.721 -178.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.7 t70 . . . . . 0 CA--C 1.498 -1.035 0 N-CA-C 108.85 -0.796 . . . . 2.07 108.85 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.433 ' HA ' HD13 ' A' ' 33' ' ' LEU . 19.6 p90 -108.96 12.55 25.26 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 120.198 -0.601 . . . . 0.44 110.734 -178.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.568 HD23 ' HB2' ' A' ' 71' ' ' PRO . 57.2 mt -51.45 -28.63 13.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.834 1.79 . . . . 0.39 115.834 -176.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -96.73 -6.79 35.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.489 0.661 . . . . 2.04 111.534 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.9 mp -79.82 129.68 34.69 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 121.875 -0.516 . . . . 1.37 110.122 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.76 137.78 39.51 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 109.455 -0.572 . . . . 3.94 109.455 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -58.54 -49.72 76.38 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 123.69 0.619 . . . . 0.35 110.23 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -57.28 -27.37 62.06 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.466 0.479 . . . . 2.79 111.697 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -81.74 -32.22 31.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.752 0.31 . . . . 0.88 110.315 -176.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.5 pt -93.72 23.18 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 112.224 0.453 . . . . 0.6 112.224 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 78.44 14.88 81.69 Favored Glycine 0 C--O 1.24 0.507 0 C-N-CA 121.118 -0.563 . . . . 0.66 113.855 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -103.36 125.77 50.16 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.007 0.432 . . . . 1.33 111.097 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -87.46 138.48 31.44 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 108.195 -1.039 . . . . 1.06 108.195 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.3 p -51.4 -33.09 28.74 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 123.718 0.636 . . . . 1.03 112.33 173.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.77 -48.66 71.07 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.199 -0.667 . . . . 1.56 109.199 177.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.21 -34.09 76.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.464 0.649 . . . . 0.43 109.949 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.454 ' O ' ' HB ' ' A' ' 48' ' ' THR . 64.2 tp -63.13 -33.49 75.57 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.0 -1.0 . . . . 0.43 111.188 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.9 mtm -64.24 -33.81 76.66 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.413 -0.515 . . . . 1.49 110.775 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.08 -34.05 77.49 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-O 121.631 0.729 . . . . 1.88 109.556 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.74 HG21 HD23 ' A' ' 14' ' ' LEU . 37.2 m -66.21 -57.51 7.43 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.843 -1.169 . . . . 0.45 107.843 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.528 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.5 -36.17 66.38 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 113.963 -1.471 . . . . 0.27 109.595 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.16 -44.4 87.9 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 123.085 0.554 . . . . 0.33 112.279 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 38.0 mtp180 -66.19 -34.24 77.59 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.382 0.611 . . . . 2.84 109.975 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 49' ' ' ALA . 94.5 mt -65.71 -44.9 84.7 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.575 -0.739 . . . . 0.9 109.977 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.65 ' HA ' HG12 ' A' ' 58' ' ' VAL . 47.2 mt-10 -58.1 -44.17 87.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.48 109.927 174.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -61.3 -59.63 5.0 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.496 -1.229 . . . . 1.19 110.817 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -66.12 -41.94 89.83 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.77 1.026 . . . . 3.07 113.77 -177.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -95.26 -17.88 21.32 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.97 1.1 . . . . 1.01 113.97 -172.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.21 65.79 1.89 Allowed Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.012 -1.09 . . . . 0.93 110.858 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.65 HG12 ' HA ' ' A' ' 53' ' ' GLU . 10.6 p -140.63 176.18 5.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 107.969 -1.123 . . . . 1.16 107.969 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.476 ' H ' HG22 ' A' ' 58' ' ' VAL . 22.2 p -140.96 105.47 4.87 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.594 0.711 . . . . 1.87 110.01 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.407 HD12 ' HB1' ' A' ' 49' ' ' ALA . 73.7 mt -96.9 122.5 56.47 Favored Pre-proline 0 C--N 1.291 -1.955 0 CA-C-N 115.738 -0.664 . . . . 0.57 109.543 -174.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.89 128.47 26.87 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.715 2.277 . . . . 0.87 111.531 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -52.97 -37.78 61.5 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.777 1.231 . . . . 1.83 111.435 -178.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.54 -40.98 85.02 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 115.088 -0.96 . . . . 2.34 110.492 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.692 HG11 ' HG ' ' A' ' 77' ' ' LEU . 61.4 t -74.54 -45.05 46.54 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.221 -0.659 . . . . 0.66 109.221 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.23 -36.89 66.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.51 111.861 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.73 22.66 34.92 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.302 -0.952 . . . . 0.61 112.782 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -135.03 4.66 3.26 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.821 0.82 . . . . 3.98 110.162 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 m -82.01 124.08 38.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.009 -0.737 . . . . 0.44 109.009 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.37 -40.09 13.82 Favored 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 120.993 -0.283 . . . . 1.91 111.641 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 33.3 p -119.55 151.32 51.54 Favored Pre-proline 0 N--CA 1.417 -2.085 0 O-C-N 123.324 0.39 . . . . 0.47 110.672 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.568 ' HB2' HD23 ' A' ' 31' ' ' LEU . 68.6 Cg_exo -55.38 -32.24 80.8 Favored 'Trans proline' 0 C--O 1.206 -1.079 0 C-N-CA 123.657 2.905 . . . . 0.32 112.097 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.0 ttm105 -52.28 -48.26 65.41 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.769 0.668 . . . . 1.48 110.154 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -63.78 -48.9 75.09 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.95 0.9 . . . . 2.13 110.949 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.436 HD12 HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -66.48 -44.95 81.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.023 -0.99 . . . . 0.9 110.407 -176.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.7 tp -57.78 -47.22 83.18 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.135 0.574 . . . . 0.34 109.974 178.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.2 -47.71 80.58 Favored 'General case' 0 CA--C 1.506 -0.734 0 O-C-N 123.822 0.701 . . . . 0.57 111.689 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.692 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -59.66 -48.89 79.88 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 124.011 0.82 . . . . 1.96 109.872 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.9 mt -69.24 -39.22 78.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 116.164 -0.471 . . . . 0.55 110.541 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.501 ' HA ' HD11 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -60.65 -43.46 97.58 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.917 -0.129 . . . . 1.14 111.098 177.492 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.79 -42.59 98.47 Favored Glycine 0 N--CA 1.448 -0.531 0 O-C-N 123.481 0.488 . . . . 0.53 111.924 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.88 -42.9 72.85 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.072 0.463 . . . . 0.6 110.716 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.14 -14.61 62.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.881 0.697 . . . . 1.42 112.881 179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.779 0 CA-C-O 121.468 0.652 . . . . 0.85 109.686 173.896 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.458 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 30.1 tp . . . . . 0 N--CA 1.419 -1.995 0 N-CA-C 105.059 -2.2 . . . . 1.51 105.059 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 88.5 mt -122.86 123.03 40.08 Favored 'General case' 0 C--N 1.284 -2.243 0 N-CA-C 108.251 -1.018 . . . . 0.8 108.251 173.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.0 p -101.54 -170.47 1.83 Allowed 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 107.841 -1.17 . . . . 0.63 107.841 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.548 HG21 ' HA ' ' A' ' 29' ' ' ASP . 3.3 m -54.58 -54.57 39.62 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 123.294 0.638 . . . . 0.61 111.407 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -73.08 -28.47 62.31 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.703 -0.399 . . . . 1.65 111.805 -176.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.88 -38.56 86.53 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 108.636 -0.875 . . . . 1.41 108.636 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 75' ' ' LEU . 14.2 tp -66.48 -45.62 79.04 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.225 -0.898 . . . . 0.48 108.671 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.548 ' O ' HG23 ' A' ' 15' ' ' VAL . 2.5 tmt_? -50.62 -51.43 48.8 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.12 0.968 . . . . 2.46 109.709 175.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -57.72 -42.25 83.43 Favored 'General case' 0 C--N 1.313 -1.013 0 C-N-CA 124.824 1.249 . . . . 3.93 110.883 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.84 99.91 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 115.467 -0.788 . . . . 0.5 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.62 HD12 HG21 ' A' ' 48' ' ' THR . 11.1 mp -63.79 -41.64 97.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.98 -0.554 . . . . 1.44 111.133 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 11' ' ' ARG . 66.8 t -56.35 -55.98 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.526 -0.546 . . . . 0.8 109.526 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.407 ' HB3' ' NH1' ' A' ' 51' ' ' ARG . 34.5 mm-40 -54.91 -49.11 72.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.517 -0.765 . . . . 2.05 111.968 -178.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.5 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 4.0 m . . . . . 0 C--N 1.304 -1.374 0 N-CA-C 112.27 0.47 . . . . 1.39 112.27 -173.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.548 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.3 t70 . . . . . 0 N--CA 1.447 -0.595 0 CA-C-O 121.15 0.5 . . . . 2.07 110.251 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -115.82 13.29 16.07 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.683 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.784 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 48.6 mt -51.66 -21.68 2.84 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.687 1.736 . . . . 0.39 115.687 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -90.74 -21.63 21.47 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.181 0.515 . . . . 2.04 111.531 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mp -77.86 117.92 19.68 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 116.079 -0.51 . . . . 1.37 110.084 -175.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -71.92 144.84 48.82 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.648 -0.871 . . . . 3.94 108.648 -176.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.476 ' HA ' HG12 ' A' ' 38' ' ' ILE . 66.9 m-85 -57.26 -45.69 83.76 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.37 0.508 . . . . 0.35 112.37 -175.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.8 -31.19 70.58 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.712 0.767 . . . . 2.79 111.37 178.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -81.54 -17.82 47.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.242 -0.89 . . . . 0.88 109.939 -175.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.476 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.1 pt -101.8 14.47 5.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.381 0.61 . . . . 0.6 111.622 173.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.4 18.71 77.62 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.636 -0.711 . . . . 0.66 114.153 175.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -98.84 128.15 44.97 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 122.422 -0.457 . . . . 1.33 111.788 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -88.72 151.05 22.66 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.991 -1.114 . . . . 1.06 107.991 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.552 ' O ' ' HG3' ' A' ' 46' ' ' MET . 60.7 p -53.99 -28.38 37.51 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.456 0.539 . . . . 1.03 112.456 175.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.63 -58.6 6.95 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.365 -0.606 . . . . 1.56 109.365 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.095 0.474 . . . . 0.43 110.577 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.493 ' O ' ' HB ' ' A' ' 48' ' ' THR . 57.6 tp -62.54 -45.18 94.14 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.523 -0.762 . . . . 0.43 110.818 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.552 ' HG3' ' O ' ' A' ' 42' ' ' SER . 61.7 mtt -63.65 -40.71 97.55 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.6 0.238 . . . . 1.49 110.544 177.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.07 -29.02 70.19 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.767 0.794 . . . . 1.88 111.055 177.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.62 HG21 HD12 ' A' ' 14' ' ' LEU . 92.3 m -65.91 -54.8 21.71 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.152 -1.425 . . . . 0.45 107.152 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.523 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.6 -33.79 68.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.816 -1.538 . . . . 0.27 110.73 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.435 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -57.33 -46.99 82.72 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.408 0.683 . . . . 0.33 112.275 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.407 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 47.3 mtp180 -64.63 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.369 0.604 . . . . 2.84 109.782 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 49' ' ' ALA . 83.0 mt -66.67 -43.25 85.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.416 -0.811 . . . . 0.9 110.221 177.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.5 mt-10 -55.18 -53.74 52.12 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.175 -0.676 . . . . 0.48 109.175 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -62.64 -42.54 99.66 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.062 -0.972 . . . . 1.19 112.609 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.06 -42.71 93.95 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.488 0.551 . . . . 3.07 112.488 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -96.4 -0.23 49.59 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 113.932 1.086 . . . . 1.01 113.932 -173.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 67.64 48.27 57.27 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 111.241 -0.744 . . . . 0.93 111.241 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 59' ' ' SER . 12.7 p -139.01 176.01 6.92 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 N-CA-C 107.612 -1.255 . . . . 1.16 107.612 -177.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.412 ' H ' HG22 ' A' ' 58' ' ' VAL . 16.2 t -142.17 143.41 32.95 Favored 'General case' 0 N--CA 1.421 -1.905 0 N-CA-C 108.808 -0.812 . . . . 1.87 108.808 175.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.523 HD12 ' HB1' ' A' ' 49' ' ' ALA . 64.6 mt -121.82 123.39 27.43 Favored Pre-proline 0 C--N 1.296 -1.735 0 N-CA-C 107.417 -1.327 . . . . 0.57 107.417 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.07 138.91 81.31 Favored 'Trans proline' 0 C--O 1.254 1.278 0 C-N-CA 122.356 2.038 . . . . 0.87 111.158 177.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -53.54 -38.69 64.04 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.877 0.871 . . . . 1.83 111.296 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.53 -33.88 75.96 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.407 -0.361 . . . . 2.34 111.247 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 81.2 t -73.1 -50.17 33.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 N-CA-C 108.083 -1.081 . . . . 0.66 108.083 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.62 -26.35 61.44 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.198 -0.91 . . . . 0.51 112.396 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.89 0.98 51.81 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.615 -0.802 . . . . 0.61 113.635 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -98.63 -16.3 19.12 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 117.779 0.789 . . . . 3.98 110.631 -178.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.554 HG21 HD23 ' A' ' 74' ' ' LEU . 23.1 m -74.41 113.44 12.86 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-N 115.508 -0.769 . . . . 0.44 109.81 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -89.66 -39.03 13.47 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-N 115.553 -0.748 . . . . 1.91 111.801 -177.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 37.3 p -115.65 150.77 45.33 Favored Pre-proline 0 N--CA 1.416 -2.134 0 CA-C-N 115.675 -0.693 . . . . 0.47 109.969 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.784 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.2 Cg_exo -53.99 -40.45 81.03 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.623 2.882 . . . . 0.32 114.502 -178.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -36.48 64.13 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.698 0.681 . . . . 1.48 111.677 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -62.6 -53.54 53.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.274 -0.639 . . . . 2.13 109.274 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.554 HD23 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -65.38 -46.43 80.12 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.9 110.051 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.537 ' HB2' HD22 ' A' ' 10' ' ' LEU . 43.4 tp -58.17 -52.82 63.97 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.077 -0.51 . . . . 0.34 111.064 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.93 -39.37 93.4 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.012 0.375 . . . . 0.57 112.012 -176.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.21 -42.54 99.4 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.645 0.26 . . . . 1.96 111.236 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.26 -43.23 65.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 110.022 -0.362 . . . . 0.55 110.022 178.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -52.61 -47.23 67.1 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.713 0.405 . . . . 1.14 111.328 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.31 -44.19 96.73 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.628 -0.589 . . . . 0.53 111.628 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.95 74.78 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 122.814 0.446 . . . . 0.6 111.07 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 78.6 mt -67.74 -39.36 84.25 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 122.754 0.422 . . . . 1.42 110.352 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.7 0 CA-C-N 115.755 -0.657 . . . . 0.85 110.357 176.853 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 82' ' ' LEU . 10.1 mp . . . . . 0 CA--C 1.486 -1.512 0 CA-C-O 121.538 0.685 . . . . 1.51 110.792 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 52' ' ' LEU . 38.9 mt -89.56 126.37 35.58 Favored 'General case' 0 C--N 1.273 -2.723 0 CA-C-N 114.385 -1.28 . . . . 0.8 109.873 -173.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.5 p -99.42 -170.13 1.86 Allowed 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 107.06 -1.459 . . . . 0.63 107.06 169.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 m -52.37 -54.21 34.81 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 118.399 0.545 . . . . 0.61 111.385 -178.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -64.43 -41.81 96.37 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 116.163 -0.471 . . . . 1.65 111.71 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -65.47 -43.5 90.07 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 121.185 0.517 . . . . 1.41 110.046 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.748 HD11 HD22 ' A' ' 74' ' ' LEU . 40.9 tp -65.58 -44.4 86.81 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.393 -0.821 . . . . 0.48 109.776 -178.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.476 ' O ' HG23 ' A' ' 15' ' ' VAL . 36.9 ttm105 -52.29 -44.4 65.0 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.709 0.631 . . . . 2.46 110.93 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 75.9 ttt180 -56.37 -40.05 73.94 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.531 0.519 . . . . 3.93 111.192 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.31 -37.48 85.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.711 0.291 . . . . 0.5 110.524 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.559 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.53 -34.28 77.56 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.192 -0.458 . . . . 1.44 110.28 175.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 11' ' ' ARG . 28.3 t -73.13 -29.79 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.415 0.626 . . . . 0.8 109.826 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 22.2 mm-40 -61.16 -53.11 61.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.457 -0.792 . . . . 2.05 110.168 177.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 112.061 0.393 . . . . 1.39 112.061 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.2 t70 . . . . . 0 CA--C 1.512 -0.491 0 CA-C-O 121.335 0.588 . . . . 2.07 110.003 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.401 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 10.2 p90 -113.23 13.08 19.13 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.785 -0.643 . . . . 0.44 111.207 -175.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.678 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 38.5 mt -52.11 -25.23 8.34 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.608 1.707 . . . . 0.39 115.608 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -100.24 -10.26 21.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 2.04 111.121 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -79.97 119.79 23.29 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.805 -0.443 . . . . 1.37 109.805 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.89 151.1 38.97 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.161 -0.472 . . . . 3.94 109.862 -175.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.633 ' HA ' HG12 ' A' ' 38' ' ' ILE . 68.9 m-85 -68.53 -37.07 79.68 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 116.305 -0.407 . . . . 0.35 110.585 -176.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -57.85 -29.26 64.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.165 0.507 . . . . 2.79 110.969 175.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -83.11 -31.46 27.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.711 -0.677 . . . . 0.88 111.22 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.633 HG12 ' HA ' ' A' ' 35' ' ' PHE . 34.9 pt -93.84 24.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.185 0.517 . . . . 0.6 111.922 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 36.24 91.03 Favored Glycine 0 N--CA 1.453 -0.183 0 CA-C-N 115.292 -0.867 . . . . 0.66 113.582 176.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.53 122.17 45.74 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.182 0.515 . . . . 1.33 112.129 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.72 148.72 24.62 Favored 'General case' 0 CA--C 1.485 -1.552 0 N-CA-C 107.821 -1.177 . . . . 1.06 107.821 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 46' ' ' MET . 31.1 p -54.75 -33.99 61.96 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 113.556 0.946 . . . . 1.03 113.556 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 tt -66.38 -45.24 80.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.066 -0.716 . . . . 1.56 109.066 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.41 87.49 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.099 -0.501 . . . . 0.43 110.043 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.404 HD21 HG23 ' A' ' 68' ' ' VAL . 55.6 tp -62.9 -39.36 94.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.273 -0.876 . . . . 0.43 111.185 178.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 42' ' ' SER . 65.5 mtm -64.08 -31.27 72.4 Favored 'General case' 0 C--O 1.199 -1.596 0 C-N-CA 120.66 -0.416 . . . . 1.49 110.969 177.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.55 -34.28 77.87 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.521 0.677 . . . . 1.88 110.191 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.559 HG21 HD13 ' A' ' 14' ' ' LEU . 35.8 m -64.12 -59.47 4.4 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 106.859 -1.534 . . . . 0.45 106.859 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.31 -38.08 70.78 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.05 -1.432 . . . . 0.27 110.16 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.0 80.84 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.242 0.617 . . . . 0.33 112.533 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -64.45 -36.39 84.0 Favored 'General case' 0 C--O 1.226 -0.171 0 N-CA-C 109.618 -0.512 . . . . 2.84 109.618 179.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.524 HD22 HD11 ' A' ' 5' ' ' LEU . 83.8 mt -64.97 -45.4 85.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.75 -0.659 . . . . 0.9 111.181 176.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 43.9 mt-10 -56.27 -50.53 71.11 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 122.845 0.458 . . . . 0.48 109.881 176.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -61.82 -43.21 99.31 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.68 -1.146 . . . . 1.19 110.095 -177.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.472 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 31.3 ttm180 -65.94 -52.39 50.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.334 -0.394 . . . . 3.07 111.902 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.472 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 85.3 m-85 -92.97 -17.55 23.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.376 1.251 . . . . 1.01 114.376 -170.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.8 53.11 4.71 Favored Glycine 0 C--N 1.312 -0.75 0 C-N-CA 119.99 -1.1 . . . . 0.93 110.762 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.09 140.66 43.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 N-CA-C 108.544 -0.909 . . . . 1.16 108.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 p -93.78 115.13 27.52 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 112.194 0.442 . . . . 1.87 112.194 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.2 mt -104.42 118.05 57.65 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.553 -0.906 . . . . 0.57 108.553 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -57.53 123.35 13.57 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.594 2.196 . . . . 0.87 111.313 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -50.38 -47.82 56.11 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.488 1.115 . . . . 1.83 113.692 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.31 -32.69 70.55 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 120.885 0.374 . . . . 2.34 110.641 -176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.26 -41.11 57.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 108.584 -0.895 . . . . 0.66 108.584 179.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.28 -33.96 68.17 Favored 'General case' 0 C--O 1.214 -0.78 0 C-N-CA 123.712 0.805 . . . . 0.51 111.589 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -90.41 -17.01 54.32 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.434 -0.889 . . . . 0.61 112.76 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -101.57 7.36 42.28 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.587 0.958 . . . . 3.98 113.587 -177.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.404 HG23 HD21 ' A' ' 45' ' ' LEU . 12.7 m -77.3 114.22 17.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 106.904 -1.517 . . . . 0.44 106.904 171.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -90.36 -34.69 15.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 121.619 0.723 . . . . 1.91 110.527 -173.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.406 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 67.9 p -117.42 142.52 30.45 Favored Pre-proline 0 N--CA 1.411 -2.423 0 CA-C-N 115.343 -0.844 . . . . 0.47 109.961 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.678 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 76.9 Cg_exo -55.5 -28.9 66.72 Favored 'Trans proline' 0 CA--C 1.499 -1.24 0 C-N-CA 123.866 3.044 . . . . 0.32 111.946 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -50.3 -51.71 42.85 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 124.425 1.078 . . . . 1.48 109.668 174.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -65.67 -42.48 91.26 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 115.101 -0.954 . . . . 2.13 111.249 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.748 HD22 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -66.49 -44.07 83.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.964 -0.754 . . . . 0.9 108.964 -177.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -56.98 -51.86 67.54 Favored 'General case' 0 C--O 1.245 0.854 0 C-N-CA 123.525 0.73 . . . . 0.34 109.226 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.35 -44.07 92.72 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.813 -1.085 . . . . 0.57 111.407 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.7 tp -57.85 -50.06 74.59 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.751 0.82 . . . . 1.96 111.341 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.7 mt -70.55 -40.29 77.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.393 -0.523 . . . . 0.55 110.724 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.432 ' OD1' HD23 ' A' ' 4' ' ' LEU . 13.8 m-80 -60.99 -39.63 90.4 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.48 0.181 . . . . 1.14 110.745 177.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.85 -39.78 64.67 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.314 -0.469 . . . . 0.53 112.445 178.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.65 -45.03 65.91 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.838 0.352 . . . . 0.6 110.936 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 4' ' ' LEU . 21.5 mt -69.36 -15.5 63.33 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.402 0.681 . . . . 1.42 112.486 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.525 0 CA-C-O 121.526 0.679 . . . . 0.85 109.182 173.031 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 28.9 tp . . . . . 0 N--CA 1.405 -2.709 0 N-CA-C 106.227 -1.768 . . . . 1.51 106.227 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.441 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 85.9 mt -120.14 123.67 43.9 Favored 'General case' 0 N--CA 1.406 -2.665 0 N-CA-C 108.273 -1.01 . . . . 0.8 108.273 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.7 p -98.37 -179.87 4.49 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 106.585 -1.635 . . . . 0.63 106.585 172.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.783 HG21 ' HA ' ' A' ' 29' ' ' ASP . 20.6 m -59.47 -31.93 69.78 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 118.638 0.654 . . . . 0.61 110.505 175.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.24 -46.72 63.89 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.44 -0.578 . . . . 1.65 109.44 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -64.51 -39.54 93.96 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.589 -0.732 . . . . 1.41 109.527 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.554 HD11 HD12 ' A' ' 74' ' ' LEU . 15.0 tp -65.49 -51.38 60.48 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 114.893 -1.048 . . . . 0.48 109.195 -177.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -52.32 -40.65 62.15 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 2.46 111.766 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.535 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 60.6 ttt180 -54.3 -54.52 39.09 Favored 'General case' 0 C--O 1.24 0.577 0 O-C-N 123.549 0.531 . . . . 3.93 110.586 176.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.46 -39.13 89.76 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.536 -0.756 . . . . 0.5 111.547 -175.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.8 -50.99 68.84 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.162 0.288 . . . . 1.44 111.174 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.8 t -63.52 -34.72 69.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 CA-C-O 120.999 0.428 . . . . 0.8 111.46 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 95.6 mt-10 -63.22 -49.31 74.68 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.245 0.545 . . . . 2.05 111.218 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 p . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 115.473 -0.785 . . . . 1.39 112.889 -174.744 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.783 ' HA ' HG21 ' A' ' 7' ' ' THR . 10.2 m-20 . . . . . 0 CA--C 1.496 -1.115 0 N-CA-C 109.064 -0.717 . . . . 2.07 109.064 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.411 ' HB2' HD12 ' A' ' 33' ' ' LEU . 23.6 p90 -123.32 19.08 9.8 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.943 -0.762 . . . . 0.44 108.943 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.687 HD13 ' HB3' ' A' ' 72' ' ' ARG . 29.3 mt -53.63 -23.19 10.39 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.58 1.326 . . . . 0.39 114.58 -175.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -92.0 -22.53 19.93 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.894 0.378 . . . . 2.04 110.475 -176.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.411 HD12 ' HB2' ' A' ' 30' ' ' PHE . 66.3 mt -77.59 114.09 16.08 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.824 -1.176 . . . . 1.37 107.824 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -75.72 146.74 39.87 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 120.128 -0.629 . . . . 3.94 109.631 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.568 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.5 m-85 -55.22 -40.88 71.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.993 -0.549 . . . . 0.35 111.424 -175.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.06 -34.78 63.87 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.814 -0.63 . . . . 2.79 111.724 178.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.2 -34.23 32.42 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.143 -0.481 . . . . 0.88 110.259 -174.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 pt -90.8 17.7 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 113.118 0.784 . . . . 0.6 113.118 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.81 14.47 67.47 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 114.564 0.586 . . . . 0.66 114.564 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.568 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 32.6 m-85 -101.33 115.17 29.88 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 120.796 0.331 . . . . 1.33 111.418 -179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -87.22 154.54 20.63 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.427 -1.694 . . . . 1.06 106.427 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.554 ' O ' ' HG3' ' A' ' 46' ' ' MET . 44.1 p -51.44 -27.88 11.46 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 113.509 0.929 . . . . 1.03 113.509 177.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.35 -57.76 8.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.162 -0.681 . . . . 1.56 109.162 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.68 78.25 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.23 0.538 . . . . 0.43 110.391 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 57.8 tp -62.69 -33.6 75.4 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.121 -0.945 . . . . 0.43 110.95 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.554 ' HG3' ' O ' ' A' ' 42' ' ' SER . 69.3 mtm -65.81 -29.76 70.29 Favored 'General case' 0 C--O 1.199 -1.559 0 C-N-CA 120.164 -0.615 . . . . 1.49 112.084 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 36.2 tt0 -65.79 -29.12 69.56 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.803 0.811 . . . . 1.88 109.505 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 24.6 m -64.62 -58.01 7.5 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 106.193 -1.78 . . . . 0.45 106.193 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.33 -38.44 74.11 Favored 'General case' 0 C--O 1.2 -1.523 0 CA-C-N 113.875 -1.512 . . . . 0.27 110.759 176.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.66 -45.31 81.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.531 0.732 . . . . 0.33 112.348 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.522 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 50.6 mtt180 -64.83 -38.63 91.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.744 -0.662 . . . . 2.84 109.572 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 48' ' ' THR . 86.7 mt -65.71 -41.39 92.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.055 -0.975 . . . . 0.9 110.271 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 37.7 mt-10 -57.0 -54.85 42.11 Favored 'General case' 0 CA--C 1.502 -0.885 0 O-C-N 123.624 0.577 . . . . 0.48 109.813 175.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.3 t -62.33 -38.5 89.7 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.501 -0.772 . . . . 1.19 111.928 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -68.1 -51.02 51.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.693 0.627 . . . . 3.07 112.693 177.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.474 ' HB2' HG12 ' A' ' 58' ' ' VAL . 65.0 m-85 -93.77 -12.38 29.25 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.749 1.018 . . . . 1.01 113.749 -171.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.63 17.94 79.45 Favored Glycine 0 C--N 1.308 -1.006 0 C-N-CA 120.698 -0.763 . . . . 0.93 111.285 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.474 HG12 ' HB2' ' A' ' 56' ' ' TYR . 7.5 p -98.38 135.06 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 N-CA-C 107.948 -1.13 . . . . 1.16 107.948 -178.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 m -92.87 118.45 31.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.997 -0.742 . . . . 1.87 108.997 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.1 mt -103.29 117.55 59.96 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.548 -0.908 . . . . 0.57 108.548 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.34 128.19 29.1 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.839 2.359 . . . . 0.87 110.977 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -51.28 -38.75 54.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.363 1.065 . . . . 1.83 111.943 -177.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.68 -45.31 79.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.901 -0.591 . . . . 2.34 110.652 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.99 -36.06 56.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 O-C-N 123.428 0.455 . . . . 0.66 109.879 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.48 -32.17 64.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.475 -0.784 . . . . 0.51 111.365 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 42' ' ' SER . . . -116.98 23.13 10.15 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.5 -0.857 . . . . 0.61 112.297 178.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -101.15 -22.16 14.76 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.45 0.643 . . . . 3.98 110.334 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.509 HG21 ' HB2' ' A' ' 74' ' ' LEU . 17.8 m -76.19 130.8 35.89 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 CA-C-N 114.984 -1.007 . . . . 0.44 111.594 -175.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.43 -50.09 6.78 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.706 -0.679 . . . . 1.91 111.343 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 32.2 p -109.13 149.23 39.4 Favored Pre-proline 0 N--CA 1.405 -2.701 0 CA-C-N 115.846 -0.615 . . . . 0.47 110.479 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.494 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 89.3 Cg_exo -51.82 -38.81 68.32 Favored 'Trans proline' 0 C--O 1.211 -0.831 0 C-N-CA 123.269 2.646 . . . . 0.32 112.228 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.687 ' HB3' HD13 ' A' ' 31' ' ' LEU . 13.6 ptt180 -55.63 -35.17 65.6 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.676 0.991 . . . . 1.48 113.676 176.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -63.78 -50.62 68.29 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.791 0.805 . . . . 2.13 109.137 176.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.554 HD12 HD11 ' A' ' 10' ' ' LEU . 3.4 tm? -66.57 -47.22 73.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.319 -1.31 . . . . 0.9 109.906 -176.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.415 HD13 HD22 ' A' ' 10' ' ' LEU . 51.4 tp -56.78 -48.77 77.12 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.646 0.778 . . . . 0.34 110.735 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.68 -44.05 82.82 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.346 -0.388 . . . . 0.57 111.52 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.11 -47.94 83.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.004 -0.544 . . . . 1.96 109.565 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.15 -35.21 52.44 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 C-N-CA 120.158 -0.617 . . . . 0.55 111.439 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.1 -44.02 82.8 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 117.969 0.35 . . . . 1.14 110.8 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.18 -43.33 98.77 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.541 -0.624 . . . . 0.53 111.541 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.58 -25.77 65.06 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.974 0.416 . . . . 0.6 111.271 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 66.6 mt -79.58 -40.66 28.9 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 116.207 -0.451 . . . . 1.42 110.513 177.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.62 0 CA-C-O 121.439 0.638 . . . . 0.85 110.174 177.29 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' A' ' 82' ' ' LEU . 11.5 tp . . . . . 0 N--CA 1.407 -2.6 0 CA-C-O 122.031 0.919 . . . . 1.51 112.498 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.428 HD21 ' CZ ' ' A' ' 56' ' ' TYR . 96.4 mt -101.66 131.34 47.94 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 114.419 -1.264 . . . . 0.8 108.941 176.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p -102.22 -176.44 3.12 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.963 -1.495 . . . . 0.63 106.963 170.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.0 m -58.14 -39.7 79.44 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 118.284 0.493 . . . . 0.61 111.371 177.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.84 -42.53 94.84 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.104 0.478 . . . . 1.65 110.05 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -67.89 -41.19 83.14 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.685 -0.689 . . . . 1.41 109.601 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.428 HD11 ' CD1' ' A' ' 74' ' ' LEU . 28.0 tp -64.82 -43.82 91.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.762 -1.108 . . . . 0.48 110.539 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 11' ' ' ARG . 40.3 ttp180 -49.93 -41.74 46.92 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.471 0.708 . . . . 2.46 111.92 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.418 ' HG2' ' OE2' ' A' ' 16' ' ' GLU . 40.6 ttm180 -55.47 -43.76 75.8 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.915 0.76 . . . . 3.93 111.116 -177.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.465 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -63.68 -42.08 98.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.239 -0.437 . . . . 0.5 110.839 -178.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.648 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -64.83 -37.06 86.34 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.358 -0.383 . . . . 1.44 110.519 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.64 -53.31 32.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 N-CA-C 109.937 -0.394 . . . . 0.8 109.937 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.418 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.9 mt-10 -58.97 -40.6 85.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.902 -0.59 . . . . 2.05 112.503 -177.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.9 p . . . . . 0 C--N 1.318 -0.792 0 C-N-CA 119.998 -0.681 . . . . 1.39 112.465 -179.423 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.766 ' HA ' HG21 ' A' ' 7' ' ' THR . 6.6 p-10 . . . . . 0 N--CA 1.433 -1.285 0 N-CA-C 108.591 -0.892 . . . . 2.07 108.591 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.32 19.49 15.51 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.49 0.662 . . . . 0.44 109.518 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.64 ' O ' ' HB ' ' A' ' 70' ' ' THR . 59.5 mt -51.98 -32.08 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 114.716 1.376 . . . . 0.39 114.716 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -94.73 -1.88 52.15 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.101 0.477 . . . . 2.04 112.007 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp -81.34 129.52 34.66 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.722 -0.844 . . . . 1.37 108.722 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 142.61 43.77 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 108.033 -1.099 . . . . 3.94 108.033 -177.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.525 ' HA ' HG12 ' A' ' 38' ' ' ILE . 73.2 m-85 -60.13 -41.8 93.45 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 120.546 -0.462 . . . . 0.35 109.8 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.25 -27.02 61.7 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.039 -0.528 . . . . 2.79 112.101 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.19 -34.47 37.39 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.651 -0.87 . . . . 0.88 108.651 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.525 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.8 pt -91.64 16.95 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.049 0.452 . . . . 0.6 110.803 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.84 55.77 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.55 -0.75 . . . . 0.66 113.701 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -118.09 108.93 15.82 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 113.156 0.798 . . . . 1.33 113.156 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.35 147.45 26.52 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 106.924 -1.51 . . . . 1.06 106.924 174.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.521 ' O ' ' HG3' ' A' ' 46' ' ' MET . 18.0 p -50.87 -31.04 16.14 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 114.237 1.199 . . . . 1.03 114.237 -178.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.77 -53.94 43.06 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.226 -1.028 . . . . 1.56 108.226 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.51 -35.24 79.83 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.29 0.567 . . . . 0.43 110.32 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 59.8 tp -61.57 -37.71 84.84 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.352 -0.84 . . . . 0.43 111.615 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.521 ' HG3' ' O ' ' A' ' 42' ' ' SER . 59.9 mtm -63.78 -33.4 75.57 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 120.735 -0.386 . . . . 1.49 110.657 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -66.78 -32.18 73.3 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 121.946 0.879 . . . . 1.88 109.805 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.648 HG21 HD13 ' A' ' 14' ' ' LEU . 55.6 m -66.52 -55.86 13.57 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.411 -1.329 . . . . 0.45 107.411 178.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.511 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -55.92 -38.21 69.97 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.72 -1.582 . . . . 0.27 109.855 177.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.85 80.26 Favored 'General case' 0 C--O 1.251 1.17 0 C-N-CA 123.099 0.56 . . . . 0.33 112.45 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 -66.31 -38.72 88.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.967 -0.561 . . . . 2.84 109.724 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 13' ' ' ALA . 85.4 mt -63.98 -45.68 87.98 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.422 -0.808 . . . . 0.9 110.498 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.8 mt-10 -56.53 -49.6 74.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.83 -0.623 . . . . 0.48 110.084 176.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.2 t -62.37 -54.73 36.17 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.983 -1.008 . . . . 1.19 110.894 -177.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.91 -38.13 89.94 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.375 0.879 . . . . 3.07 113.375 -174.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.428 ' CZ ' HD21 ' A' ' 5' ' ' LEU . 99.4 m-85 -98.7 -9.52 24.5 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 114.504 1.298 . . . . 1.01 114.504 -173.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.42 50.58 8.11 Favored Glycine 0 C--N 1.316 -0.557 0 C-N-CA 120.278 -0.963 . . . . 0.93 111.792 178.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.3 p -142.61 175.48 4.42 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 N-CA-C 106.96 -1.496 . . . . 1.16 106.96 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.6 t -142.22 139.34 31.97 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 119.19 0.905 . . . . 1.87 109.802 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.511 HD12 ' HB1' ' A' ' 49' ' ' ALA . 70.5 mt -114.1 129.46 24.79 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 108.043 -1.095 . . . . 0.57 108.043 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.73 113.98 2.21 Favored 'Trans proline' 0 C--O 1.245 0.844 0 C-N-CA 122.005 1.803 . . . . 0.87 109.742 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -55.49 -29.72 59.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.612 0.765 . . . . 1.83 113.004 -176.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -68.63 -41.03 80.02 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.823 -0.436 . . . . 2.34 109.823 178.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.2 t -75.17 -34.79 32.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.163 -0.68 . . . . 0.66 109.163 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.08 65.54 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.694 -0.685 . . . . 0.51 110.99 176.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -91.8 -3.74 68.1 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.591 -0.814 . . . . 0.61 112.76 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -101.37 -14.45 17.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.333 0.587 . . . . 3.98 110.829 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.4 m -76.17 124.25 33.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 CA-C-O 121.047 0.451 . . . . 0.44 109.904 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -92.29 -33.18 14.73 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 115.915 -0.584 . . . . 1.91 111.712 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.64 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 40.2 p -125.63 152.25 71.75 Favored Pre-proline 0 N--CA 1.418 -2.037 0 CA-C-N 115.645 -0.707 . . . . 0.47 110.085 -177.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.588 ' HB2' HD23 ' A' ' 31' ' ' LEU . 54.2 Cg_exo -56.37 -26.3 61.73 Favored 'Trans proline' 0 C--O 1.2 -1.409 0 C-N-CA 123.57 2.846 . . . . 0.32 111.109 176.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -51.22 -57.21 9.4 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.84 0.856 . . . . 1.48 109.961 174.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -64.32 -41.11 96.99 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.463 -0.789 . . . . 2.13 110.885 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.428 ' CD1' HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -67.54 -46.17 73.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.47 -0.786 . . . . 0.9 110.691 -177.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.6 tp -57.6 -52.16 66.56 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.007 -0.738 . . . . 0.34 109.007 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -52.39 -44.6 65.43 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.811 1.244 . . . . 0.57 111.414 177.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 67.9 tp -62.38 -51.3 68.11 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.732 0.813 . . . . 1.96 111.197 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 74' ' ' LEU . 58.8 mt -66.33 -39.75 84.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.165 -0.47 . . . . 0.55 110.119 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.95 -43.8 86.58 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.411 -0.359 . . . . 1.14 110.121 176.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.23 -42.7 97.8 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.575 -0.739 . . . . 0.53 112.003 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.84 79.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.757 0.313 . . . . 0.6 110.746 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 4' ' ' LEU . 71.0 mt -65.58 -36.65 84.39 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.647 0.379 . . . . 1.42 110.978 176.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.63 0 CA-C-N 116.069 -0.514 . . . . 0.85 110.6 176.168 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.5 mtp . . . . . 0 CA--C 1.506 -0.747 0 N-CA-C 107.458 -1.312 . . . . 6.63 107.458 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -54.16 -39.27 66.39 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.487 -0.931 . . . . 4.09 108.487 174.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.527 ' O ' ' HB3' ' A' ' 82' ' ' LEU . 1.9 p -73.08 108.29 5.9 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-N 113.79 -1.55 . . . . 2.77 108.806 173.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.6 tp -158.33 152.19 23.72 Favored 'General case' 0 N--CA 1.389 -3.509 0 CA-C-N 114.756 -1.111 . . . . 1.51 108.636 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.5 HD21 ' CE2' ' A' ' 56' ' ' TYR . 88.7 mt -116.19 130.91 57.02 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 108.193 -1.04 . . . . 0.8 108.193 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 45.3 p -102.02 -174.82 2.67 Favored 'General case' 0 C--N 1.29 -1.979 0 N-CA-C 108.017 -1.105 . . . . 0.63 108.017 173.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.912 HG21 ' HA ' ' A' ' 29' ' ' ASP . 12.0 m -57.01 -45.71 82.87 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.02 0.438 . . . . 0.61 110.278 178.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 18.0 t70 -57.22 -45.17 84.12 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.861 0.864 . . . . 1.65 111.298 178.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 5' ' ' LEU . 15.4 m-20 -67.1 -39.66 86.75 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.367 0.603 . . . . 1.41 110.102 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.4 HD11 ' CD1' ' A' ' 74' ' ' LEU . 9.8 tp -65.94 -42.46 90.02 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.099 -0.955 . . . . 0.48 109.04 -177.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.533 ' HG3' ' HB3' ' A' ' 26' ' ' LEU . 39.0 ttm180 -53.02 -48.74 67.33 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-N 115.135 -0.939 . . . . 2.46 109.518 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.557 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 48.3 mtt180 -54.03 -44.53 71.06 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 115.016 -0.993 . . . . 3.93 111.648 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.83 -45.93 91.7 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 123.53 0.519 . . . . 0.5 110.719 -178.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.42 HD12 HG21 ' A' ' 48' ' ' THR . 9.4 mp -67.3 -31.64 72.07 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.998 0.37 . . . . 1.44 111.998 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 11' ' ' ARG . 95.6 t -64.75 -48.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 N-CA-C 108.581 -0.896 . . . . 0.8 108.581 175.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.557 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 47.0 mt-10 -58.14 -48.03 81.49 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 115.623 -0.717 . . . . 2.05 110.991 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 18.9 p -73.78 -17.03 61.14 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.305 0.854 . . . . 1.39 113.305 -177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -86.82 -23.97 25.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.079 0.466 . . . . 1.58 110.281 178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.43 -132.85 11.09 Favored Glycine 0 N--CA 1.434 -1.448 0 N-CA-C 111.48 -0.648 . . . . 2.32 111.48 177.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -85.29 92.49 8.45 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-O 121.359 0.6 . . . . 5.17 109.894 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -132.89 174.31 10.47 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 114.955 -1.021 . . . . 4.86 109.789 179.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -98.72 -15.78 19.23 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 107.763 -1.199 . . . . 4.5 107.763 176.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.69 6.17 56.4 Favored Glycine 0 N--CA 1.429 -1.791 0 CA-C-N 114.937 -1.028 . . . . 2.77 111.197 -179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 74.3 p 40.34 -115.85 0.23 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.242 1.417 . . . . 2.87 114.361 178.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -104.22 20.12 18.93 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 115.356 -0.838 . . . . 3.23 112.026 -177.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.533 ' HB3' ' HG3' ' A' ' 11' ' ' ARG . 9.1 mp -81.65 2.9 27.43 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.01 0.434 . . . . 1.16 110.93 177.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.2 m -60.88 135.83 57.9 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 124.277 1.031 . . . . 1.46 110.175 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.13 -138.16 32.45 Favored Glycine 0 N--CA 1.434 -1.495 0 N-CA-C 110.917 -0.873 . . . . 1.02 110.917 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.912 ' HA ' HG21 ' A' ' 7' ' ' THR . 5.2 m-20 -92.05 113.62 25.94 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 109.521 -0.548 . . . . 2.07 109.521 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' HD13 ' A' ' 33' ' ' LEU . 18.7 p90 -109.0 14.13 24.24 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 109.093 -0.706 . . . . 0.44 109.093 178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.776 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 67.2 mt -53.54 -26.85 22.91 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 113.608 0.966 . . . . 0.39 113.608 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -95.11 -11.01 29.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.3 -0.409 . . . . 2.04 111.274 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 30' ' ' PHE . 9.5 mp -82.05 116.25 21.56 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.659 -0.867 . . . . 1.37 108.659 175.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.3 mtm180 -75.7 149.89 37.99 Favored 'General case' 0 C--N 1.282 -2.341 0 CA-C-N 115.287 -0.87 . . . . 3.94 110.426 -173.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.485 ' HA ' HG12 ' A' ' 38' ' ' ILE . 56.7 m-85 -61.96 -39.84 93.52 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.423 -0.353 . . . . 0.35 111.097 -176.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -58.01 -31.99 67.49 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.401 0.619 . . . . 2.79 111.137 176.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -82.37 -26.01 33.29 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.349 -0.841 . . . . 0.88 111.246 -175.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.485 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.3 pt -98.07 14.42 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.097 0.475 . . . . 0.6 111.245 176.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.39 40.96 99.73 Favored Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.767 -0.651 . . . . 0.66 113.116 178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.447 ' HB2' HG13 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -115.97 113.96 23.97 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.482 -0.562 . . . . 1.33 109.482 179.18 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -85.83 156.94 20.35 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 109.338 -0.616 . . . . 1.06 109.338 178.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.534 ' O ' ' HG3' ' A' ' 46' ' ' MET . 24.4 p -53.39 -33.75 54.99 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 113.108 0.781 . . . . 1.03 113.108 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.3 -49.13 70.66 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.927 -0.768 . . . . 1.56 108.927 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.34 -40.51 96.62 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 109.605 -0.517 . . . . 0.43 109.605 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 68' ' ' VAL . 63.8 tp -60.62 -41.65 95.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.995 -1.002 . . . . 0.43 111.223 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.8 mtp -61.68 -40.58 95.47 Favored 'General case' 0 C--O 1.205 -1.27 0 CA-C-N 116.609 -0.269 . . . . 1.49 110.344 177.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.532 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 34.5 tt0 -65.42 -34.86 79.29 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-O 121.471 0.653 . . . . 1.88 110.511 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.42 HG21 HD12 ' A' ' 14' ' ' LEU . 60.1 m -64.03 -56.74 12.88 Favored 'General case' 0 C--N 1.31 -1.149 0 N-CA-C 107.252 -1.388 . . . . 0.45 107.252 178.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.55 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.0 -36.27 70.21 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 113.923 -1.489 . . . . 0.27 109.995 176.546 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.512 ' HA ' ' OE1' ' A' ' 53' ' ' GLU . . . -58.68 -40.99 85.16 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 123.466 0.706 . . . . 0.33 112.414 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 62.6 mtp85 -63.35 -42.32 98.9 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.376 -0.972 . . . . 2.84 108.376 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.32 -41.75 89.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.389 -1.278 . . . . 0.9 111.185 178.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.512 ' OE1' ' HA ' ' A' ' 50' ' ' ALA . 50.2 mt-10 -55.81 -53.2 59.57 Favored 'General case' 0 CA--C 1.507 -0.698 0 C-N-CA 123.262 0.625 . . . . 0.48 109.836 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.8 m -62.49 -46.62 87.61 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 114.938 -1.028 . . . . 1.19 111.357 -178.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -65.46 -45.78 82.43 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.7 -0.682 . . . . 3.07 112.373 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.5 ' CE2' HD21 ' A' ' 5' ' ' LEU . 94.0 m-85 -97.19 6.37 48.55 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 113.179 0.807 . . . . 1.01 113.179 -175.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.29 52.72 49.82 Favored Glycine 0 N--CA 1.444 -0.805 0 CA-C-N 115.984 -0.553 . . . . 0.93 112.188 177.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.526 HG11 HD12 ' A' ' 82' ' ' LEU . 28.6 m -132.86 176.52 8.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 N-CA-C 109.665 -0.494 . . . . 1.16 109.665 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.8 t -141.9 129.62 21.62 Favored 'General case' 0 N--CA 1.42 -1.968 0 N-CA-C 107.95 -1.13 . . . . 1.87 107.95 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.55 HD12 ' HB1' ' A' ' 49' ' ' ALA . 92.9 mt -106.93 124.19 36.16 Favored Pre-proline 0 C--N 1.295 -1.772 0 CA-C-N 115.926 -0.579 . . . . 0.57 109.513 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 126.5 21.73 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.048 2.499 . . . . 0.87 111.719 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -52.99 -30.75 36.99 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 124.809 1.244 . . . . 1.83 113.43 -177.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 11.4 t70 -69.82 -47.65 61.99 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 109.276 -0.639 . . . . 2.34 109.276 177.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.7 t -72.4 -33.25 45.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.495 -0.775 . . . . 0.66 110.618 -174.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.69 -27.42 62.89 Favored 'General case' 0 C--O 1.22 -0.475 0 CA-C-N 115.862 -0.608 . . . . 0.51 111.443 178.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -120.85 19.43 8.91 Favored Glycine 0 N--CA 1.434 -1.455 0 N-CA-C 111.06 -0.816 . . . . 0.61 111.06 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 14.5 tpp180 -100.9 -19.27 15.98 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.254 -0.647 . . . . 3.98 109.254 -178.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.461 HG23 HD21 ' A' ' 45' ' ' LEU . 30.2 m -79.05 123.7 36.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 CA-C-N 115.04 -0.982 . . . . 0.44 111.615 -177.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -91.71 -31.78 15.68 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 115.279 -0.873 . . . . 1.91 110.075 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.405 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 21.5 p -125.22 145.25 50.02 Favored Pre-proline 0 N--CA 1.418 -2.034 0 CA-C-N 115.337 -0.847 . . . . 0.47 110.395 -176.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.776 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 77.1 Cg_exo -54.03 -32.1 67.24 Favored 'Trans proline' 0 C--O 1.215 -0.648 0 C-N-CA 123.732 2.954 . . . . 0.32 113.192 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 5.2 ptp180 -52.9 -43.38 66.14 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.222 0.326 . . . . 1.48 111.774 176.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -64.55 -48.05 76.51 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.595 0.758 . . . . 2.13 109.978 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.458 ' HB2' HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -66.4 -42.09 88.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.925 -1.034 . . . . 0.9 110.114 -176.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 42.8 tp -57.07 -52.31 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.552 -0.536 . . . . 0.34 109.552 176.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.7 -43.32 94.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.5 -0.773 . . . . 0.57 111.763 -179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.61 -46.9 87.58 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 109.781 -0.451 . . . . 1.96 109.781 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.79 -35.42 55.04 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 C-N-CA 120.944 -0.302 . . . . 0.55 110.583 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.75 -40.79 89.33 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 120.689 0.28 . . . . 1.14 110.47 175.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.01 -32.43 69.6 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 115.776 -0.647 . . . . 0.53 112.449 177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.12 60.95 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.819 0.819 . . . . 0.6 109.641 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.527 ' HB3' ' O ' ' A' ' 3' ' ' THR . 8.5 mp -72.62 -6.7 46.04 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.075 -0.966 . . . . 1.42 111.724 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.02 -28.28 66.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.549 0.69 . . . . 0.85 109.904 170.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -108.56 -34.22 6.8 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.562 -0.745 . . . . 2.44 111.679 -177.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -107.3 140.44 40.21 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.307 0.575 . . . . 2.12 112.072 -176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.472 ' HA ' HG21 ' A' ' 3' ' ' THR . . . . . . . . 0 N--CA 1.429 -1.52 0 N-CA-C 108.291 -1.003 . . . . 3.84 108.291 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.447 ' HG2' ' HA ' ' A' ' 86' ' ' ALA . 66.4 mtt . . . . . 0 CA--C 1.506 -0.713 0 N-CA-C 110.3 -0.259 . . . . 6.63 110.3 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.83 144.66 46.21 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.505 -0.554 . . . . 4.09 109.505 178.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 t -89.04 123.24 33.16 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-O 122.116 0.96 . . . . 2.77 109.772 179.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 12.1 tp -61.15 151.99 29.78 Favored 'General case' 0 N--CA 1.418 -2.074 0 CA-C-N 113.585 -1.643 . . . . 1.51 110.714 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.532 HD11 HD12 ' A' ' 52' ' ' LEU . 73.8 mt -98.9 133.27 43.42 Favored 'General case' 0 C--N 1.287 -2.151 0 CA-C-N 115.604 -0.726 . . . . 0.8 110.024 -178.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 42.3 p -99.92 -176.6 3.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 107.457 -1.312 . . . . 0.63 107.457 170.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.675 HG21 ' HA ' ' A' ' 29' ' ' ASP . 16.7 m -57.64 -38.86 75.76 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.11 -0.7 . . . . 0.61 109.11 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -60.03 -47.43 85.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.781 -1.1 . . . . 1.65 111.272 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.22 -39.76 89.83 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.835 -0.621 . . . . 1.41 110.098 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 17.3 tp -65.08 -45.05 86.85 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.943 -1.026 . . . . 0.48 109.265 -177.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.488 ' NE ' ' HA ' ' A' ' 27' ' ' SER . 36.8 ttm180 -50.75 -54.56 22.35 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 124.0 0.92 . . . . 2.46 109.914 177.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 23.3 ttp180 -56.05 -46.33 78.94 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 114.67 -1.15 . . . . 3.93 111.689 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.535 ' HB1' HD21 ' A' ' 52' ' ' LEU . . . -62.16 -40.65 96.7 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 123.367 0.417 . . . . 0.5 111.281 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -64.12 -38.65 91.82 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.634 0.254 . . . . 1.44 111.34 176.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 11' ' ' ARG . 89.3 t -66.71 -47.59 82.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.857 -0.423 . . . . 0.8 109.857 178.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 45.9 mt-10 -59.37 -39.69 84.07 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.289 -0.414 . . . . 2.05 111.021 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.573 ' CB ' ' HA ' ' A' ' 48' ' ' THR . 20.6 m -75.27 -15.79 60.49 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 121.302 0.573 . . . . 1.39 112.114 -178.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.3 -6.72 49.76 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.551 -0.907 . . . . 1.58 108.551 175.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 80.24 -97.19 1.66 Allowed Glycine 0 N--CA 1.429 -1.775 0 N-CA-C 108.942 -1.663 . . . . 2.32 108.942 -176.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -162.28 93.23 0.85 Allowed 'General case' 0 C--N 1.293 -1.876 0 N-CA-C 106.837 -1.542 . . . . 5.17 106.837 173.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 m -115.42 -85.75 0.61 Allowed 'General case' 0 C--N 1.29 -1.982 0 CA-C-N 115.345 -0.843 . . . . 4.86 109.17 -178.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -114.99 -53.78 2.61 Favored 'General case' 0 C--N 1.293 -1.88 0 N-CA-C 108.834 -0.802 . . . . 4.5 108.834 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.79 -22.37 21.93 Favored Glycine 0 C--O 1.242 0.603 0 CA-C-N 116.012 -0.54 . . . . 2.77 113.551 175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.5 p 53.24 -169.01 0.05 OUTLIER 'General case' 0 C--O 1.249 1.064 0 C-N-CA 125.734 1.614 . . . . 2.87 112.629 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -97.38 83.13 3.23 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 105.328 -2.101 . . . . 3.23 105.328 170.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.8 tp -101.18 -1.84 32.85 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 114.745 -1.116 . . . . 1.16 109.342 -173.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.488 ' HA ' ' NE ' ' A' ' 11' ' ' ARG . 19.8 m -69.09 143.69 54.14 Favored 'General case' 0 N--CA 1.424 -1.733 0 CA-C-N 114.874 -1.057 . . . . 1.46 109.714 178.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.54 -161.56 19.67 Favored Glycine 0 N--CA 1.422 -2.247 0 N-CA-C 109.168 -1.573 . . . . 1.02 109.168 -174.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.675 ' HA ' HG21 ' A' ' 7' ' ' THR . 19.9 t70 -97.5 106.14 18.4 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.609 -0.885 . . . . 2.07 108.609 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.442 ' HB2' HD12 ' A' ' 33' ' ' LEU . 25.1 p90 -101.32 14.92 30.47 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 116.431 -0.35 . . . . 0.44 111.624 -175.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.72 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 41.0 mt -52.75 -25.62 11.72 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.919 1.451 . . . . 0.39 114.919 -178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -92.19 -16.94 25.56 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.945 0.402 . . . . 2.04 111.315 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.442 HD12 ' HB2' ' A' ' 30' ' ' PHE . 81.2 mt -77.53 114.78 16.72 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 121.308 0.575 . . . . 1.37 109.735 -176.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HG2' HG22 ' A' ' 70' ' ' THR . 46.1 mtp180 -72.64 141.01 48.31 Favored 'General case' 0 C--N 1.291 -1.956 0 CA-C-N 115.19 -0.914 . . . . 3.94 109.903 -172.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 38.9 m-85 -60.69 -39.35 88.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.501 -0.318 . . . . 0.35 110.258 -177.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -56.7 -31.78 64.83 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.517 0.727 . . . . 2.79 111.142 177.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -82.65 -34.34 27.52 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.087 -0.506 . . . . 0.88 110.91 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.468 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.1 pt -90.79 9.71 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 N-CA-C 112.511 0.56 . . . . 0.6 112.511 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.51 29.88 31.63 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 115.639 -0.709 . . . . 0.66 114.401 174.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 8.6 m-85 -111.59 121.46 45.21 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 117.25 0.525 . . . . 1.33 111.271 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -84.65 152.62 23.66 Favored 'General case' 0 CA--C 1.491 -1.32 0 N-CA-C 107.093 -1.447 . . . . 1.06 107.093 173.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.443 ' O ' ' HG3' ' A' ' 46' ' ' MET . 13.5 p -54.27 -30.44 50.57 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 112.914 0.709 . . . . 1.03 112.914 176.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.3 tt -65.33 -52.37 54.32 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 109.08 -0.711 . . . . 1.56 109.08 177.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.26 -33.04 74.63 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.372 0.606 . . . . 0.43 110.247 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.543 HD21 HG23 ' A' ' 68' ' ' VAL . 44.8 tp -63.48 -46.73 84.81 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-N 115.51 -0.768 . . . . 0.43 110.199 176.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.549 ' HG2' ' HB1' ' A' ' 65' ' ' ALA . 70.8 mtm -63.92 -33.95 76.87 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.392 -0.367 . . . . 1.49 111.129 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -62.9 -33.48 75.41 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-O 121.957 0.884 . . . . 1.88 109.032 174.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.573 ' HA ' ' CB ' ' A' ' 17' ' ' SER . 86.5 m -68.99 -62.21 1.47 Allowed 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 114.747 -1.115 . . . . 0.45 108.845 179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.456 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.77 -25.32 54.91 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.912 -1.04 . . . . 0.27 111.575 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.5 -43.65 84.34 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 123.288 0.635 . . . . 0.33 110.668 177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -66.38 -37.41 85.21 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.108 -0.951 . . . . 2.84 110.769 179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.535 HD21 ' HB1' ' A' ' 13' ' ' ALA . 3.9 mm? -62.66 -43.7 98.14 Favored 'General case' 0 N--CA 1.434 -1.266 0 C-N-CA 122.315 0.246 . . . . 0.9 110.431 177.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.401 ' OE1' ' HA ' ' A' ' 59' ' ' SER . 43.1 mt-10 -58.0 -48.15 80.88 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 123.67 0.606 . . . . 0.48 110.638 175.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.8 m -63.4 -53.96 44.25 Favored 'General case' 0 CA--C 1.559 1.29 0 CA-C-O 121.196 0.522 . . . . 1.19 112.282 178.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -62.3 -38.04 87.87 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.948 0.899 . . . . 3.07 112.938 -174.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 85.5 m-85 -102.29 -1.24 31.49 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 114.098 1.148 . . . . 1.01 114.098 -177.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 61.79 52.14 52.58 Favored Glycine 0 CA--C 1.505 -0.542 0 N-CA-C 111.195 -0.762 . . . . 0.93 111.195 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.56 HG22 ' H ' ' A' ' 59' ' ' SER . 7.4 p -136.18 178.02 5.6 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 108.287 -1.005 . . . . 1.16 108.287 -174.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.56 ' H ' HG22 ' A' ' 58' ' ' VAL . 7.0 p -138.59 137.33 36.87 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-O 121.032 0.444 . . . . 1.87 109.977 -178.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.456 HD12 ' HB1' ' A' ' 49' ' ' ALA . 87.2 mt -113.53 132.74 22.39 Favored Pre-proline 0 C--N 1.293 -1.881 0 N-CA-C 108.628 -0.878 . . . . 0.57 108.628 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -61.71 123.36 12.53 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 122.196 1.93 . . . . 0.87 111.012 177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -53.42 -31.74 46.6 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.315 1.046 . . . . 1.83 111.018 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -65.66 -49.16 69.63 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.853 -1.067 . . . . 2.34 111.04 -179.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.691 HG11 ' HG ' ' A' ' 77' ' ' LEU . 40.9 t -72.88 -33.81 44.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 N-CA-C 109.805 -0.443 . . . . 0.66 109.805 -176.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.549 ' HB1' ' HG2' ' A' ' 46' ' ' MET . . . -58.05 -24.43 58.35 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 112.979 0.733 . . . . 0.51 112.979 -179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.63 2.81 34.25 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.495 -0.86 . . . . 0.61 112.364 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -108.1 -9.54 15.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 112.298 0.481 . . . . 3.98 112.298 -178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.543 HG23 HD21 ' A' ' 45' ' ' LEU . 15.5 m -79.35 111.42 16.15 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.119 0 CA-C-O 121.465 0.65 . . . . 0.44 111.448 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -91.87 -31.93 15.5 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-N 115.667 -0.697 . . . . 1.91 110.219 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.423 HG22 ' HG2' ' A' ' 34' ' ' ARG . 41.1 p -121.69 145.31 42.76 Favored Pre-proline 0 N--CA 1.428 -1.55 0 CA-C-N 115.325 -0.852 . . . . 0.47 111.016 -179.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.72 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 56.8 Cg_exo -55.83 -34.17 90.57 Favored 'Trans proline' 0 C--O 1.212 -0.78 0 C-N-CA 123.916 3.078 . . . . 0.32 113.214 -178.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 3.5 ptp180 -51.8 -45.86 64.02 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 123.346 0.403 . . . . 1.48 111.804 176.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -64.54 -44.83 89.56 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.532 0.682 . . . . 2.13 110.096 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -67.84 -47.65 68.39 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.952 -1.022 . . . . 0.9 110.657 -177.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 40.8 tp -58.48 -51.77 68.45 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.635 0.374 . . . . 0.34 110.95 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -58.71 -38.54 78.53 Favored 'General case' 0 N--CA 1.48 1.047 0 O-C-N 123.324 0.39 . . . . 0.57 110.93 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.691 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -62.49 -49.81 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.444 -0.576 . . . . 1.96 109.444 178.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 59.6 mt -67.34 -36.87 77.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 116.455 -0.339 . . . . 0.55 110.248 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -61.79 -37.06 82.96 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.873 -0.418 . . . . 1.14 109.873 176.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -69.51 -37.13 78.15 Favored Glycine 0 N--CA 1.441 -0.969 0 CA-C-N 115.68 -0.691 . . . . 0.53 111.944 178.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.19 -44.86 67.83 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.189 0.519 . . . . 0.6 109.957 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 76.8 mt -66.96 -20.55 65.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.982 -0.554 . . . . 1.42 111.692 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.01 -27.04 69.14 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 122.979 0.511 . . . . 0.85 110.898 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -93.0 -4.95 51.72 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.782 -0.644 . . . . 2.44 110.129 -178.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 1' ' ' MET . . . -94.67 31.58 1.77 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.583 0.706 . . . . 2.12 110.2 -177.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.447 ' HA ' ' HG2' ' A' ' 1' ' ' MET . . . . . . . . 0 C--N 1.305 -1.34 0 N-CA-C 108.34 -0.985 . . . . 3.84 108.34 178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.3 mmm . . . . . 0 CA--C 1.506 -0.718 0 N-CA-C 109.098 -0.704 . . . . 6.63 109.098 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.58 -49.55 14.4 Favored 'General case' 0 N--CA 1.439 -0.993 0 N-CA-C 108.405 -0.961 . . . . 4.09 108.405 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 56.0 m -91.75 106.57 18.57 Favored 'General case' 0 N--CA 1.419 -1.989 0 CA-C-O 122.778 1.275 . . . . 2.77 109.021 178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 29.8 tp -155.78 161.0 40.75 Favored 'General case' 0 N--CA 1.388 -3.55 0 N-CA-C 103.937 -2.616 . . . . 1.51 103.937 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.434 ' HG ' HD11 ' A' ' 82' ' ' LEU . 92.1 mt -89.53 123.05 33.28 Favored 'General case' 0 C--N 1.285 -2.197 0 N-CA-C 108.82 -0.807 . . . . 0.8 108.82 178.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 74.7 p -101.87 -173.91 2.46 Favored 'General case' 0 C--N 1.282 -2.348 0 N-CA-C 107.313 -1.365 . . . . 0.63 107.313 172.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.501 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.6 m -57.23 -42.47 81.45 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 109.153 -0.684 . . . . 0.61 109.153 173.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -59.28 -48.91 79.85 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 124.424 1.089 . . . . 1.65 110.821 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -68.79 -39.54 80.11 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 116.027 -0.533 . . . . 1.41 111.421 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.434 HD22 HD13 ' A' ' 75' ' ' LEU . 18.6 tp -67.01 -45.2 78.29 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.795 -0.638 . . . . 0.48 109.978 -177.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.551 ' HG3' ' HG ' ' A' ' 26' ' ' LEU . 43.8 ttp-105 -53.81 -45.78 70.91 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.559 -0.746 . . . . 2.46 109.882 177.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.545 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 66.9 mtp180 -55.84 -43.82 77.4 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 115.058 -0.974 . . . . 3.93 112.11 178.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.408 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -61.18 -45.43 94.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 123.73 0.644 . . . . 0.5 110.217 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.9 mp -65.52 -30.8 71.6 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.245 0.461 . . . . 1.44 112.245 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 11' ' ' ARG . 48.2 t -72.83 -34.69 47.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.156 -0.683 . . . . 0.8 109.156 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 44.2 mt-10 -66.19 -42.04 89.39 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.455 -0.338 . . . . 2.05 111.493 177.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.555 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 4.7 p -77.41 -42.02 37.77 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 113.896 1.073 . . . . 1.39 113.896 -177.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.43 -37.82 31.31 Favored 'General case' 0 CA--C 1.506 -0.733 0 CA-C-O 121.119 0.485 . . . . 1.58 110.785 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 90.06 178.05 44.73 Favored Glycine 0 N--CA 1.424 -2.15 0 N-CA-C 109.777 -1.329 . . . . 2.32 109.777 -176.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.91 83.04 7.6 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-O 121.924 0.869 . . . . 5.17 110.085 177.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 38.4 p -79.93 -95.55 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.507 0 CA-C-N 114.796 -1.093 . . . . 4.86 109.591 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -87.39 -14.01 41.81 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 107.349 -1.352 . . . . 4.5 107.349 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.47 -25.04 29.47 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 109.431 -1.468 . . . . 2.77 109.431 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p 55.45 -175.42 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 126.597 1.959 . . . . 2.87 113.136 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -120.23 70.52 0.88 Allowed 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 107.136 -1.431 . . . . 3.23 107.136 171.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.551 ' HG ' ' HG3' ' A' ' 11' ' ' ARG . 15.1 tp -105.7 -17.14 14.48 Favored 'General case' 0 C--N 1.284 -2.271 0 CA-C-N 113.598 -1.637 . . . . 1.16 107.904 -176.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.452 ' HA ' ' HD2' ' A' ' 11' ' ' ARG . 10.1 p -51.28 129.79 25.41 Favored 'General case' 0 N--CA 1.441 -0.921 0 C-N-CA 125.46 1.504 . . . . 1.46 112.881 -178.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.55 -116.24 4.58 Favored Glycine 0 N--CA 1.425 -2.087 0 CA-C-N 115.148 -0.933 . . . . 1.02 111.671 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.501 ' HA ' HG21 ' A' ' 7' ' ' THR . 3.8 m-20 -112.71 126.17 55.11 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.32 -0.993 . . . . 2.07 108.32 -175.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 14.9 p90 -128.86 11.81 6.15 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.734 -0.786 . . . . 0.44 111.348 -177.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.851 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 44.8 mt -53.02 -29.13 27.7 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.735 1.383 . . . . 0.39 114.735 -176.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -98.73 -6.08 30.18 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.964 0.411 . . . . 2.04 111.842 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.7 mp -82.33 124.51 30.05 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 108.807 -0.812 . . . . 1.37 108.807 178.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 42.5 mtp180 -76.04 143.58 41.32 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 116.47 -0.332 . . . . 3.94 110.855 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.443 ' HA ' HG12 ' A' ' 38' ' ' ILE . 77.2 m-85 -63.68 -44.1 94.72 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.463 -0.335 . . . . 0.35 111.014 -177.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -57.95 -26.23 61.98 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.085 0.469 . . . . 2.79 111.75 178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.46 -30.45 27.22 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.168 -0.469 . . . . 0.88 110.681 -176.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.443 HG12 ' HA ' ' A' ' 35' ' ' PHE . 33.9 pt -92.32 19.05 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 121.122 0.487 . . . . 0.6 112.06 -176.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.41 34.3 54.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.047 -0.597 . . . . 0.66 112.011 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -116.19 118.71 33.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 121.467 0.651 . . . . 1.33 112.162 179.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -85.82 151.14 24.04 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 106.939 -1.504 . . . . 1.06 106.939 172.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.401 ' O ' ' HG3' ' A' ' 46' ' ' MET . 32.7 p -55.0 -32.27 61.66 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 112.342 0.497 . . . . 1.03 112.342 176.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 tt -63.92 -50.08 70.08 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 108.659 -0.867 . . . . 1.56 108.659 176.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.56 -38.81 88.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.901 -0.59 . . . . 0.43 109.789 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.539 HD21 HG23 ' A' ' 68' ' ' VAL . 57.7 tp -61.72 -46.41 89.77 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.329 -0.851 . . . . 0.43 110.334 177.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.401 ' HG3' ' O ' ' A' ' 42' ' ' SER . 73.1 mtm -62.56 -37.39 85.97 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 116.456 -0.338 . . . . 1.49 111.278 177.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 29.8 tt0 -63.83 -35.47 80.74 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.539 0.685 . . . . 1.88 110.285 176.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.8 m -65.6 -53.25 44.35 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.227 -1.397 . . . . 0.45 107.227 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.439 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.83 -38.63 72.89 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.19 -1.368 . . . . 0.27 110.033 175.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.92 -44.99 91.43 Favored 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 123.96 0.904 . . . . 0.33 112.061 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 53.2 mtt180 -62.68 -38.78 91.71 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.701 -0.851 . . . . 2.84 108.701 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.408 HD21 ' HB2' ' A' ' 13' ' ' ALA . 96.6 mt -65.87 -41.18 91.92 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.041 -0.981 . . . . 0.9 111.212 177.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -55.7 -55.32 33.54 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 109.086 -0.709 . . . . 0.48 109.086 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 20.8 m -62.42 -51.24 68.31 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 114.534 -1.212 . . . . 1.19 112.433 -177.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -65.77 -38.09 88.11 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.037 0.754 . . . . 3.07 113.037 -176.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -100.29 3.63 43.58 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 114.121 1.156 . . . . 1.01 114.121 -175.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.27 52.16 51.5 Favored Glycine 0 N--CA 1.459 0.193 0 N-CA-C 111.501 -0.64 . . . . 0.93 111.501 178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.462 HG22 ' H ' ' A' ' 59' ' ' SER . 8.6 p -141.57 177.41 3.43 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 N-CA-C 107.853 -1.165 . . . . 1.16 107.853 -176.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.462 ' H ' HG22 ' A' ' 58' ' ' VAL . 10.8 t -141.55 155.61 45.77 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 119.271 0.942 . . . . 1.87 108.819 176.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.439 HD12 ' HB1' ' A' ' 49' ' ' ALA . 73.4 mt -135.35 125.76 16.94 Favored Pre-proline 0 C--N 1.317 -0.843 0 N-CA-C 109.054 -0.721 . . . . 0.57 109.054 -176.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.13 124.84 16.85 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.115 2.543 . . . . 0.87 112.09 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.567 1.321 . . . . 1.83 114.567 -173.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.578 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 15.3 t70 -71.03 -34.77 71.62 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.007 -0.677 . . . . 2.34 110.664 -176.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 40.6 t -71.39 -35.17 56.18 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 108.603 -0.888 . . . . 0.66 108.603 -177.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -24.7 63.62 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 115.173 -0.921 . . . . 0.51 110.938 174.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.4 1.67 55.99 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.093 -0.575 . . . . 0.61 112.463 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 34.6 mmt180 -97.16 -17.58 19.81 Favored 'General case' 0 CA--C 1.505 -0.778 0 O-C-N 122.243 -0.563 . . . . 3.98 110.3 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.539 HG23 HD21 ' A' ' 45' ' ' LEU . 30.6 m -76.43 109.94 11.16 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-O 122.045 0.926 . . . . 0.44 109.749 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -93.4 -30.83 14.89 Favored 'General case' 0 CA--C 1.486 -1.509 0 CA-C-N 115.033 -0.985 . . . . 1.91 109.224 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.438 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 32.9 p -118.76 136.0 23.99 Favored Pre-proline 0 N--CA 1.402 -2.841 0 CA-C-N 114.315 -1.311 . . . . 0.47 110.15 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.851 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 85.5 Cg_exo -50.58 -30.74 29.19 Favored 'Trans proline' 0 CA--C 1.51 -0.703 0 C-N-CA 124.218 3.279 . . . . 0.32 114.084 -178.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.6 ptp85 -51.72 -44.86 63.38 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 123.313 0.383 . . . . 1.48 110.891 176.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -67.89 -45.47 74.35 Favored 'General case' 0 CA--C 1.51 -0.576 0 C-N-CA 124.403 1.081 . . . . 2.13 110.03 -177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.515 HD23 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -66.62 -44.15 82.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.829 -1.078 . . . . 0.9 109.864 -176.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.434 HD13 HD22 ' A' ' 10' ' ' LEU . 42.8 tp -57.14 -52.64 64.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.309 -0.626 . . . . 0.34 109.309 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -55.27 -44.68 75.85 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.14 0.976 . . . . 0.57 111.706 -179.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.9 tp -59.47 -52.05 67.26 Favored 'General case' 0 C--O 1.246 0.914 0 CA-C-N 115.028 -0.987 . . . . 1.96 110.219 -179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 52.1 mt -69.4 -39.25 78.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.774 -0.648 . . . . 0.55 110.282 -178.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -55.98 -46.31 78.68 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.32 0.248 . . . . 1.14 111.122 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.02 -43.85 96.64 Favored Glycine 0 N--CA 1.445 -0.762 0 O-C-N 123.832 0.707 . . . . 0.53 111.545 179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.78 -38.21 73.4 Favored 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 122.652 0.381 . . . . 0.6 111.565 -179.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.434 HD11 ' HG ' ' A' ' 5' ' ' LEU . 68.5 mt -66.55 -35.14 79.51 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 122.452 0.301 . . . . 1.42 111.794 178.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.71 95.93 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.707 -0.679 . . . . 0.85 111.065 178.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -83.72 -45.86 12.91 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 112.423 0.527 . . . . 2.44 112.423 -178.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -84.93 69.35 10.77 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.726 0.774 . . . . 2.12 111.216 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.579 0 N-CA-C 107.692 -1.225 . . . . 3.84 107.692 -179.784 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.2 mtp . . . . . 0 CA--C 1.501 -0.937 0 N-CA-C 107.987 -1.116 . . . . 6.63 107.987 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.21 121.18 29.31 Favored 'General case' 0 C--N 1.296 -1.726 0 N-CA-C 108.817 -0.809 . . . . 4.09 108.817 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.605 HG22 ' HE1' ' A' ' 56' ' ' TYR . 5.6 m -93.75 106.77 18.72 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 105.983 -1.858 . . . . 2.77 105.983 176.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 16.1 tp -113.77 162.76 15.9 Favored 'General case' 0 N--CA 1.396 -3.134 0 CA-C-N 114.297 -1.319 . . . . 1.51 111.126 -168.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.74 HD21 HD22 ' A' ' 52' ' ' LEU . 68.9 mt -91.57 124.28 35.61 Favored 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 124.025 0.93 . . . . 0.8 111.317 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.4 p -97.52 -177.81 3.93 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 107.276 -1.379 . . . . 0.63 107.276 170.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.69 HG21 ' HA ' ' A' ' 29' ' ' ASP . 8.5 m -58.19 -41.72 84.57 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 109.209 -0.663 . . . . 0.61 109.209 174.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -65.44 -43.04 91.68 Favored 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 115.609 -0.723 . . . . 1.65 112.071 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' HB3' HD23 ' A' ' 5' ' ' LEU . 12.3 m-20 -64.91 -39.65 93.85 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.577 -0.527 . . . . 1.41 109.577 179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.593 HD11 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -65.4 -56.26 13.54 Favored 'General case' 0 N--CA 1.433 -1.323 0 CA-C-N 114.785 -1.098 . . . . 0.48 109.424 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -49.18 -47.97 45.5 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.693 1.197 . . . . 2.46 111.18 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -56.65 -46.16 81.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.853 -1.067 . . . . 3.93 111.154 -178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.48 -34.67 77.3 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.466 -0.788 . . . . 0.5 111.736 -176.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.412 HD13 HG21 ' A' ' 48' ' ' THR . 4.0 mm? -63.74 -57.16 10.82 Favored 'General case' 0 C--O 1.246 0.895 0 N-CA-C 109.298 -0.63 . . . . 1.44 109.298 175.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.6 t -54.48 -50.34 58.86 Favored 'Isoleucine or valine' 0 C--O 1.247 0.947 0 CA-C-N 114.916 -1.038 . . . . 0.8 111.317 -175.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -61.05 -30.07 70.11 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.268 0.47 . . . . 2.05 112.268 -178.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 41.3 m -80.27 -42.78 22.49 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.041 0.448 . . . . 1.39 112.065 -177.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.555 ' HB3' ' HG2' ' A' ' 20' ' ' GLU . . . -74.5 -32.4 62.51 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-O 121.209 0.528 . . . . 1.58 110.401 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.68 25.45 42.11 Favored Glycine 0 CA--C 1.493 -1.307 0 N-CA-C 110.857 -0.897 . . . . 2.32 110.857 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.555 ' HG2' ' HB3' ' A' ' 18' ' ' ALA . 41.8 mm-40 -71.26 136.19 47.82 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 114.495 -0.853 . . . . 5.17 111.689 -176.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.8 p -77.26 -71.65 0.4 Allowed 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 107.062 -1.459 . . . . 4.86 107.062 170.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.26 -64.14 1.04 Allowed 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.598 -0.728 . . . . 4.5 109.55 175.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.45 ' O ' ' HB ' ' A' ' 24' ' ' THR . . . 64.52 34.39 89.79 Favored Glycine 0 CA--C 1.474 -2.529 0 CA-C-N 115.777 -0.647 . . . . 2.77 114.652 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.45 ' HB ' ' O ' ' A' ' 23' ' ' GLY . 53.9 m 74.01 154.28 0.15 Allowed 'General case' 0 CA--C 1.557 1.228 0 O-C-N 124.348 0.675 . . . . 2.87 109.702 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -73.76 96.95 2.62 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.541 -1.281 . . . . 3.23 107.541 174.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.0 tp -112.95 2.86 15.97 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-N 115.731 -0.668 . . . . 1.16 110.205 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.8 p -72.85 100.35 2.88 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 115.53 -0.759 . . . . 1.46 111.764 -179.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 146.87 -167.89 28.19 Favored Glycine 0 C--O 1.259 1.665 0 N-CA-C 109.124 -1.59 . . . . 1.02 109.124 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.69 ' HA ' HG21 ' A' ' 7' ' ' THR . 8.4 m-20 -89.17 98.48 11.79 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.73 -0.841 . . . . 2.07 108.73 176.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -94.34 18.94 10.21 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.373 -0.831 . . . . 0.44 111.436 -174.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.718 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 63.4 mt -53.7 -24.93 16.2 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 114.197 1.184 . . . . 0.39 114.197 -178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.18 -19.56 19.96 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.22 0.533 . . . . 2.04 110.812 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.8 mt -80.36 128.34 33.44 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.715 -0.675 . . . . 1.37 109.887 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.72 155.37 35.69 Favored 'General case' 0 C--N 1.298 -1.643 0 CA-C-N 116.126 -0.488 . . . . 3.94 109.996 -175.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -67.1 -44.14 80.75 Favored 'General case' 0 C--N 1.311 -1.087 0 C-N-CA 120.872 -0.331 . . . . 0.35 110.432 -179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.2 -24.64 64.97 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.6 0.714 . . . . 2.79 110.533 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.78 -30.73 40.76 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.462 -0.79 . . . . 0.88 110.057 -177.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 32.5 pt -98.33 13.11 4.84 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 112.126 0.417 . . . . 0.6 112.126 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.02 48.96 18.22 Favored Glycine 0 CA--C 1.518 0.281 0 CA-C-N 115.881 -0.599 . . . . 0.66 112.91 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -134.37 118.33 17.33 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 112.699 0.629 . . . . 1.33 112.699 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -91.04 161.52 15.09 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 116.073 -0.512 . . . . 1.06 109.888 172.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.496 ' O ' ' HG3' ' A' ' 46' ' ' MET . 56.0 p -54.98 -29.44 56.99 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 114.476 1.287 . . . . 1.03 114.476 -179.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.3 tp -65.11 -50.82 64.58 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 117.991 0.36 . . . . 1.56 110.424 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -38.98 86.71 Favored 'General case' 0 C--O 1.241 0.618 0 CA-C-O 121.68 0.752 . . . . 0.43 109.637 176.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.659 ' O ' ' HB ' ' A' ' 48' ' ' THR . 29.8 tp -63.87 -40.63 97.0 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.706 -1.134 . . . . 0.43 110.989 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.5 mtm -64.58 -37.06 86.26 Favored 'General case' 0 C--O 1.217 -0.64 0 O-C-N 121.774 -0.579 . . . . 1.49 112.02 177.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -66.73 -28.58 68.54 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-O 122.103 0.954 . . . . 1.88 109.829 176.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.659 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 62.5 m -64.89 -53.84 40.18 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.57 -1.641 . . . . 0.45 106.57 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.496 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -56.49 -36.21 68.87 Favored 'General case' 0 C--O 1.205 -1.287 0 CA-C-N 114.341 -1.299 . . . . 0.27 110.041 174.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.77 -40.76 80.53 Favored 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 122.917 0.487 . . . . 0.33 112.032 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.1 mtp85 -64.79 -39.3 93.37 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 121.654 0.74 . . . . 2.84 109.159 178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.74 HD22 HD21 ' A' ' 5' ' ' LEU . 64.4 mt -65.27 -44.67 87.28 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 114.429 -1.26 . . . . 0.9 109.413 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.496 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 42.8 mt-10 -55.97 -50.55 70.5 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 115.541 -0.754 . . . . 0.48 110.227 176.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 27.1 m -62.99 -49.55 74.26 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.659 -0.701 . . . . 1.19 112.025 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 72.6 ttt180 -63.68 -44.06 94.83 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.446 0.536 . . . . 3.07 112.446 -175.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.605 ' HE1' HG22 ' A' ' 3' ' ' THR . 62.6 m-85 -94.65 -7.45 40.8 Favored 'General case' 0 C--N 1.306 -1.326 0 N-CA-C 113.08 0.77 . . . . 1.01 113.08 -173.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 69.39 51.54 26.25 Favored Glycine 0 C--O 1.24 0.483 0 N-CA-C 111.298 -0.721 . . . . 0.93 111.298 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.416 HG22 ' H ' ' A' ' 59' ' ' SER . 11.0 p -141.3 176.86 4.03 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 N-CA-C 107.62 -1.252 . . . . 1.16 107.62 -176.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.416 ' H ' HG22 ' A' ' 58' ' ' VAL . 17.7 t -139.06 132.23 29.78 Favored 'General case' 0 N--CA 1.424 -1.755 0 N-CA-C 108.433 -0.951 . . . . 1.87 108.433 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.438 HD12 ' HB1' ' A' ' 49' ' ' ALA . 67.0 mt -104.59 123.14 41.25 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.003 -0.999 . . . . 0.57 108.933 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.532 ' HB2' HG23 ' A' ' 64' ' ' VAL . 36.9 Cg_exo -58.79 118.28 5.14 Favored 'Trans proline' 0 C--O 1.25 1.11 0 C-N-CA 122.373 2.049 . . . . 0.87 110.413 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -54.92 -26.87 38.94 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.699 0.799 . . . . 1.83 112.759 -176.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -69.96 -28.92 65.95 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 116.114 -0.493 . . . . 2.34 110.749 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.532 HG23 ' HB2' ' A' ' 61' ' ' PRO . 67.2 t -76.99 -48.93 24.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 N-CA-C 108.509 -0.923 . . . . 0.66 108.509 177.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.66 -30.74 63.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 114.955 -1.02 . . . . 0.51 112.097 -178.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -89.15 -5.19 73.41 Favored Glycine 0 N--CA 1.439 -1.127 0 C-N-CA 120.051 -1.071 . . . . 0.61 113.009 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -98.53 -14.99 19.72 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.97 0.73 . . . . 3.98 112.97 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.53 HG21 HD23 ' A' ' 74' ' ' LEU . 26.7 m -79.66 121.56 33.18 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.915 0 CA-C-O 121.09 0.472 . . . . 0.44 110.933 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -93.16 -39.08 11.23 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-O 121.629 0.728 . . . . 1.91 110.911 177.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.45 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 34.9 p -115.42 138.47 23.73 Favored Pre-proline 0 N--CA 1.413 -2.316 0 CA-C-N 115.369 -0.832 . . . . 0.47 110.739 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.718 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 74.1 Cg_exo -52.75 -29.73 43.56 Favored 'Trans proline' 0 CA--C 1.508 -0.787 0 C-N-CA 124.34 3.36 . . . . 0.32 113.729 -178.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -51.36 -44.93 62.22 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 123.439 0.462 . . . . 1.48 110.581 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 31.8 mt-10 -66.82 -49.28 66.29 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 123.982 0.913 . . . . 2.13 109.786 -178.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.593 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -64.71 -43.61 92.89 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.743 -1.117 . . . . 0.9 110.193 -175.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' OD1' ' A' ' 79' ' ' ASN . 43.9 tp -57.28 -56.96 15.05 Favored 'General case' 0 N--CA 1.444 -0.727 0 O-C-N 123.667 0.604 . . . . 0.34 109.98 178.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -59.66 -45.03 93.25 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 112.888 0.699 . . . . 0.57 112.888 -177.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 73' ' ' GLU . 87.0 mt -61.77 -37.66 85.14 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 112.115 0.413 . . . . 1.96 112.115 -178.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 64.7 mt -80.72 -35.57 14.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 C-N-CA 120.23 -0.588 . . . . 0.55 109.977 177.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.404 ' OD1' ' HG ' ' A' ' 75' ' ' LEU . 11.7 m120 -57.74 -40.94 80.84 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 110.383 -0.228 . . . . 1.14 110.383 176.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.405 ' O ' ' HG2' ' A' ' 84' ' ' GLU . . . -61.61 -40.8 99.22 Favored Glycine 0 N--CA 1.45 -0.375 0 O-C-N 123.613 0.57 . . . . 0.53 112.033 176.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.27 -30.79 68.98 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.179 0.514 . . . . 0.6 110.458 179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 86.6 mt -77.19 -34.19 56.26 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-N 115.719 -0.673 . . . . 1.42 110.444 177.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.2 -33.0 74.8 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.237 0.542 . . . . 0.85 110.777 177.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 80' ' ' GLY . 11.9 pt-20 -94.84 14.82 20.25 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.77 -0.65 . . . . 2.44 111.038 178.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -93.67 161.3 14.4 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.188 -1.041 . . . . 2.12 108.188 176.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.707 0 N-CA-C 108.885 -0.783 . . . . 3.84 108.885 -176.574 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 mmt . . . . . 0 CA--C 1.497 -1.092 0 N-CA-C 107.131 -1.433 . . . . 6.63 107.131 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.46 -23.38 27.85 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.235 -1.394 . . . . 4.09 107.235 173.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.2 m -119.77 106.42 12.09 Favored 'General case' 0 N--CA 1.417 -2.118 0 CA-C-N 114.1 -1.409 . . . . 2.77 107.217 176.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.3 mp 63.0 -175.46 0.15 Allowed 'General case' 0 C--O 1.25 1.081 0 N-CA-C 115.012 1.486 . . . . 1.51 115.012 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.493 HD11 HD22 ' A' ' 52' ' ' LEU . 82.3 mt -113.86 132.9 55.73 Favored 'General case' 0 CA--C 1.491 -1.319 0 CA-C-N 113.718 -1.583 . . . . 0.8 108.431 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 39.8 p -99.8 -174.78 2.79 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 108.909 -0.775 . . . . 0.63 108.909 173.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.9 m -57.75 -45.81 85.38 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-O 121.418 0.627 . . . . 0.61 109.31 176.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -61.18 -42.35 98.42 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 114.789 -1.096 . . . . 1.65 110.636 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -66.83 -40.73 88.1 Favored 'General case' 0 CA--C 1.495 -1.148 0 CA-C-N 115.666 -0.697 . . . . 1.41 111.413 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.417 HD11 HD12 ' A' ' 74' ' ' LEU . 15.9 tp -63.85 -38.44 91.1 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.539 -0.755 . . . . 0.48 109.31 -176.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.523 ' O ' HG23 ' A' ' 15' ' ' VAL . 39.8 ttm105 -56.12 -54.35 46.17 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 115.526 -0.761 . . . . 2.46 109.998 173.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 8.6 tpt180 -57.43 -34.68 69.2 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 115.645 -0.707 . . . . 3.93 111.379 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.46 -49.96 75.46 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 123.289 0.368 . . . . 0.5 110.275 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' OH ' ' A' ' 40' ' ' TYR . 10.6 mp -67.02 -24.28 66.0 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.116 0.413 . . . . 1.44 112.116 177.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 11' ' ' ARG . 97.2 t -68.46 -45.99 81.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 108.979 -0.749 . . . . 0.8 108.979 175.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 14.4 mm-40 -62.66 -44.95 94.97 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.698 -0.683 . . . . 2.05 112.829 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.569 ' HA ' ' NH2' ' A' ' 51' ' ' ARG . 3.9 p -71.48 -30.62 66.19 Favored 'General case' 0 N--CA 1.433 -1.281 0 N-CA-C 112.64 0.608 . . . . 1.39 112.64 -178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.93 -57.22 3.97 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-O 121.375 0.607 . . . . 1.58 109.787 177.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 102.61 -129.11 9.77 Favored Glycine 0 N--CA 1.422 -2.278 0 N-CA-C 110.712 -0.955 . . . . 2.32 110.712 -177.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -91.8 13.44 18.28 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-O 120.837 0.351 . . . . 5.17 111.459 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.4 p -88.66 27.53 1.28 Allowed 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.688 0.756 . . . . 4.86 112.224 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 68.1 -61.28 0.39 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.121 1.769 . . . . 4.5 113.554 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.57 21.47 59.99 Favored Glycine 0 C--N 1.318 -0.461 0 N-CA-C 109.814 -1.314 . . . . 2.77 109.814 -173.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.4 p 61.6 -169.57 0.17 Allowed 'General case' 0 C--O 1.244 0.79 0 C-N-CA 126.598 1.959 . . . . 2.87 111.593 -176.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -84.12 105.76 15.23 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.022 -1.103 . . . . 3.23 108.022 175.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.6 tp -117.28 18.82 14.36 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.367 -0.833 . . . . 1.16 110.802 -171.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.7 m -70.1 143.94 52.26 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.786 -0.643 . . . . 1.46 110.753 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.78 -156.33 34.53 Favored Glycine 0 N--CA 1.442 -0.958 0 N-CA-C 110.796 -0.922 . . . . 1.02 110.796 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.82 134.8 33.9 Favored 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 108.551 -0.907 . . . . 2.07 108.551 177.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.485 ' HB2' HD12 ' A' ' 33' ' ' LEU . 18.6 p90 -126.48 20.33 7.31 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.896 -0.593 . . . . 0.44 109.947 -177.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.768 ' HB3' ' HB2' ' A' ' 72' ' ' ARG . 22.2 mt -53.85 -31.31 49.02 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 114.144 1.164 . . . . 0.39 114.144 -178.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -95.63 -6.63 39.71 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.94 0.4 . . . . 2.04 111.24 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 30' ' ' PHE . 65.0 mt -82.18 109.96 16.95 Favored 'General case' 0 CA--C 1.499 -1.007 0 N-CA-C 106.796 -1.557 . . . . 1.37 106.796 176.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.419 ' HD2' ' OD1' ' A' ' 69' ' ' ASP . 32.5 mtm105 -72.08 152.77 42.13 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 109.457 -0.571 . . . . 3.94 109.457 -173.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.63 -46.75 86.83 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 109.567 -0.531 . . . . 0.35 109.567 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -57.98 -23.28 53.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.814 0.446 . . . . 2.79 111.956 178.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -83.14 -28.74 29.19 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.165 0.507 . . . . 0.88 110.702 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.4 pt -97.24 13.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.303 0.573 . . . . 0.6 112.097 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.24 32.17 32.35 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.928 -0.653 . . . . 0.66 112.774 179.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.436 ' OH ' ' O ' ' A' ' 14' ' ' LEU . 2.0 m-85 -115.97 105.48 12.7 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-O 121.169 0.509 . . . . 1.33 111.388 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -83.3 158.6 22.15 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.766 -1.198 . . . . 1.06 107.766 176.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.62 ' O ' ' HG3' ' A' ' 46' ' ' MET . 53.5 p -52.19 -31.08 30.0 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 113.377 0.88 . . . . 1.03 113.377 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 65.0 tp -64.1 -51.32 64.57 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 120.982 0.42 . . . . 1.56 110.069 178.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.32 84.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.386 0.612 . . . . 0.43 109.886 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.492 HD21 HG23 ' A' ' 68' ' ' VAL . 52.9 tp -61.88 -45.44 93.75 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.239 -0.891 . . . . 0.43 110.717 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.62 ' HG3' ' O ' ' A' ' 42' ' ' SER . 54.0 mtt -62.81 -39.32 93.91 Favored 'General case' 0 C--O 1.196 -1.755 0 N-CA-C 110.247 -0.279 . . . . 1.49 110.247 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -62.37 -37.64 86.48 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.768 0.795 . . . . 1.88 108.921 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.423 HG21 HD12 ' A' ' 14' ' ' LEU . 83.8 m -67.99 -57.63 5.85 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.502 -1.227 . . . . 0.45 108.082 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.521 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.06 -32.38 66.17 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 114.532 -1.213 . . . . 0.27 111.033 178.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.05 -41.58 83.61 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 123.477 0.711 . . . . 0.33 111.721 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.569 ' NH2' ' HA ' ' A' ' 17' ' ' SER . 75.0 mtt180 -66.53 -39.9 88.85 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.84 -1.073 . . . . 2.84 109.064 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.493 HD22 HD11 ' A' ' 5' ' ' LEU . 90.3 mt -64.86 -40.56 95.35 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.143 -0.935 . . . . 0.9 110.029 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -56.3 -55.29 35.14 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.66 -0.7 . . . . 0.48 109.641 174.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.0 t -63.14 -44.38 95.69 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 115.096 -0.957 . . . . 1.19 111.731 -176.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.0 ttt180 -64.13 -49.6 71.51 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.817 0.673 . . . . 3.07 112.817 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.425 ' HB3' HD11 ' A' ' 82' ' ' LEU . 80.8 m-85 -94.13 -6.72 44.29 Favored 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 114.35 1.241 . . . . 1.01 114.35 -172.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.64 52.88 6.89 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 119.779 -1.2 . . . . 0.93 111.301 179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.556 ' HB ' HD13 ' A' ' 82' ' ' LEU . 12.0 p -138.95 176.9 5.53 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.868 0 N-CA-C 106.352 -1.721 . . . . 1.16 106.352 178.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 58' ' ' VAL . 17.1 t -141.7 145.08 34.46 Favored 'General case' 0 N--CA 1.415 -2.198 0 N-CA-C 108.712 -0.847 . . . . 1.87 108.712 177.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.521 HD12 ' HB1' ' A' ' 49' ' ' ALA . 64.4 mt -131.97 111.37 14.5 Favored Pre-proline 0 C--N 1.3 -1.557 0 N-CA-C 107.451 -1.314 . . . . 0.57 107.451 -178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.474 ' HB2' HG23 ' A' ' 64' ' ' VAL . 37.5 Cg_exo -62.02 128.97 25.67 Favored 'Trans proline' 0 C--O 1.239 0.546 0 C-N-CA 122.7 2.267 . . . . 0.87 111.039 179.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.444 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 9.4 p-10 -55.06 -30.06 58.82 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.393 1.077 . . . . 1.83 112.48 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -68.36 -35.76 78.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.334 -0.617 . . . . 2.34 109.334 -179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.474 HG23 ' HB2' ' A' ' 61' ' ' PRO . 25.3 t -76.88 -47.68 27.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 108.382 -0.97 . . . . 0.66 108.382 176.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.15 -29.32 63.52 Favored 'General case' 0 C--O 1.212 -0.878 0 C-N-CA 123.516 0.727 . . . . 0.51 112.509 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 42' ' ' SER . . . -85.55 -2.51 87.07 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.66 -0.781 . . . . 0.61 112.953 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -100.18 -24.62 14.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.639 0.219 . . . . 3.98 111.341 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG23 HD21 ' A' ' 45' ' ' LEU . 12.3 m -73.61 120.4 22.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 121.975 0.893 . . . . 0.44 111.728 -175.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' A' ' 34' ' ' ARG . 28.4 t70 -91.59 -47.48 7.38 Favored 'General case' 0 CA--C 1.498 -1.049 0 CA-C-N 114.233 -1.349 . . . . 1.91 112.386 -175.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 41.1 p -107.85 143.18 26.79 Favored Pre-proline 0 N--CA 1.408 -2.56 0 CA-C-N 116.014 -0.539 . . . . 0.47 110.91 -177.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.625 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 79.5 Cg_exo -53.74 -31.24 60.22 Favored 'Trans proline' 0 C--O 1.211 -0.839 0 C-N-CA 123.655 2.903 . . . . 0.32 111.706 176.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.768 ' HB2' ' HB3' ' A' ' 31' ' ' LEU . 25.0 ttp85 -51.4 -53.33 37.75 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 123.761 0.663 . . . . 1.48 111.03 174.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -66.84 -39.78 87.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.25 -0.432 . . . . 2.13 111.049 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.444 HD23 HG21 ' A' ' 68' ' ' VAL . 3.1 tm? -68.16 -44.85 75.05 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 116.406 -0.361 . . . . 0.9 111.207 -178.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.2 tp -56.99 -50.06 73.84 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.22 -0.659 . . . . 0.34 109.22 178.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -63.54 -37.71 88.33 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.179 -0.918 . . . . 0.57 111.635 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.445 HD11 HG12 ' A' ' 64' ' ' VAL . 5.1 tt -58.3 -52.35 65.97 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 108.835 -0.802 . . . . 1.96 108.835 178.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 66.5 mt -64.56 -50.7 74.71 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.71 0 N-CA-C 109.131 -0.692 . . . . 0.55 109.131 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -51.2 -44.05 61.5 Favored 'General case' 0 N--CA 1.476 0.834 0 O-C-N 123.547 0.53 . . . . 1.14 111.871 -178.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 84' ' ' GLU . . . -68.55 -48.73 48.79 Favored Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 121.237 -0.506 . . . . 0.53 112.456 178.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.91 -39.92 79.41 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.122 0.487 . . . . 0.6 111.276 -176.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.556 HD13 ' HB ' ' A' ' 58' ' ' VAL . 17.5 tp -70.95 -33.32 70.37 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 115.707 -0.679 . . . . 1.42 110.248 -177.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.49 -27.95 68.86 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 120.899 0.38 . . . . 0.85 111.212 175.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 80' ' ' GLY . 34.4 mm-40 -77.48 -21.32 52.99 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-N 115.867 -0.606 . . . . 2.44 111.541 -179.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.78 136.64 38.15 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.205 -0.452 . . . . 2.12 109.881 -178.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.469 0 N-CA-C 108.335 -0.987 . . . . 3.84 108.335 178.561 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.428 ' HA ' ' OXT' ' A' ' 86' ' ' ALA . 56.2 ttp . . . . . 0 CA--C 1.509 -0.631 0 N-CA-C 108.333 -0.988 . . . . 6.63 108.333 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.9 108.74 1.26 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.026 -0.731 . . . . 4.09 109.026 175.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 10.5 t -71.88 126.29 29.37 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.288 1.042 . . . . 2.77 110.077 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 14.4 tp -68.68 154.42 41.96 Favored 'General case' 0 N--CA 1.409 -2.519 0 CA-C-N 113.827 -1.533 . . . . 1.51 109.564 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 96.4 mt -102.37 124.58 48.19 Favored 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 109.318 -0.623 . . . . 0.8 109.318 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.7 p -104.26 -170.82 1.82 Allowed 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.727 -1.212 . . . . 0.63 107.727 171.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.823 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.9 m -56.07 -49.55 73.48 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.152 0.501 . . . . 0.61 110.035 177.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.32 -43.3 88.12 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 114.89 -1.05 . . . . 1.65 110.267 -177.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.13 -43.2 78.87 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-N 115.594 -0.73 . . . . 1.41 110.814 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.585 HD11 HD12 ' A' ' 74' ' ' LEU . 14.3 tp -65.19 -38.16 89.59 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 115.121 -0.945 . . . . 0.48 109.946 -175.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.796 ' HG3' ' HB3' ' A' ' 26' ' ' LEU . 36.8 ttp180 -51.01 -52.65 40.8 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.203 -0.908 . . . . 2.46 110.39 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.635 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 79.0 ttt180 -57.69 -42.77 84.34 Favored 'General case' 0 C--O 1.214 -0.777 0 CA-C-N 116.021 -0.536 . . . . 3.93 111.982 -177.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.82 -38.21 84.66 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.151 0.282 . . . . 0.5 110.663 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.605 HD23 HG21 ' A' ' 48' ' ' THR . 97.2 mt -65.85 -41.73 91.35 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.941 -0.572 . . . . 1.44 110.17 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 11' ' ' ARG . 57.3 t -61.59 -49.97 82.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 123.198 0.599 . . . . 0.8 110.111 179.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.635 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 48.1 mm-40 -57.35 -45.43 84.35 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-N 115.728 -0.669 . . . . 2.05 109.845 -178.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.514 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.8 m -74.97 -19.47 60.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.456 -0.793 . . . . 1.39 112.547 -175.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.79 -13.37 42.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.514 0.673 . . . . 1.58 109.589 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 89.91 -69.98 2.36 Favored Glycine 0 CA--C 1.494 -1.22 0 N-CA-C 110.293 -1.123 . . . . 2.32 110.293 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -136.11 118.21 15.42 Favored 'General case' 0 C--N 1.296 -1.748 0 N-CA-C 105.558 -2.016 . . . . 5.17 105.558 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.607 HG22 ' H ' ' A' ' 23' ' ' GLY . 11.2 m -113.8 133.07 55.62 Favored 'General case' 0 C--N 1.286 -2.17 0 N-CA-C 109.946 -0.39 . . . . 4.86 109.946 -173.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.19 -23.56 65.77 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.793 0.806 . . . . 4.5 109.713 176.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.607 ' H ' HG22 ' A' ' 21' ' ' THR . . . 124.29 -44.25 1.3 Allowed Glycine 0 N--CA 1.424 -2.148 0 CA-C-N 114.858 -1.064 . . . . 2.77 110.711 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.1 p 51.54 35.17 13.86 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.736 1.215 . . . . 2.87 112.705 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 30.7 t70 57.34 36.94 27.81 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.281 1.432 . . . . 3.23 111.832 -178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.796 ' HB3' ' HG3' ' A' ' 11' ' ' ARG . 6.6 mp -82.76 -8.87 59.56 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.7 -0.682 . . . . 1.16 111.207 175.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m -67.86 127.64 33.57 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.714 -0.675 . . . . 1.46 109.471 177.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 94.57 -129.48 9.92 Favored Glycine 0 N--CA 1.432 -1.579 0 N-CA-C 111.39 -0.684 . . . . 1.02 111.39 -176.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.823 ' HA ' HG21 ' A' ' 7' ' ' THR . 29.0 t70 -121.6 116.38 24.51 Favored 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 108.898 -0.778 . . . . 2.07 108.898 179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -121.86 22.2 10.47 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.96 -0.564 . . . . 0.44 111.142 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 55.6 mt -52.55 -19.47 2.31 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 115.417 1.636 . . . . 0.39 115.417 -177.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -92.97 -19.7 21.35 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 120.403 0.144 . . . . 2.04 111.345 -179.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.23 122.22 26.59 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 1.37 110.281 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.531 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 34.6 mtm105 -77.8 145.85 36.14 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.962 -0.563 . . . . 3.94 109.798 -176.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.56 ' HA ' HG12 ' A' ' 38' ' ' ILE . 46.6 m-85 -61.97 -42.08 98.73 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.582 -0.281 . . . . 0.35 110.795 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -55.94 -38.59 70.53 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.381 0.61 . . . . 2.79 110.24 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -80.11 -22.55 42.02 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.43 -0.805 . . . . 0.88 111.069 -173.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.6 pt -92.3 13.95 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.751 0.786 . . . . 0.6 110.55 177.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 83.22 6.91 87.5 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.571 -0.74 . . . . 0.66 113.81 174.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -81.83 131.86 35.27 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 112.189 0.441 . . . . 1.33 112.189 -178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -84.14 142.46 30.34 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.216 -1.772 . . . . 1.06 106.216 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.417 ' O ' ' HG3' ' A' ' 46' ' ' MET . 33.7 p -54.12 -31.98 53.76 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.522 0.934 . . . . 1.03 113.522 179.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.2 tp -64.68 -42.1 95.58 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.89 0.376 . . . . 1.56 110.234 177.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.62 -36.37 84.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.506 0.669 . . . . 0.43 109.709 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.505 HD21 HG23 ' A' ' 68' ' ' VAL . 54.7 tp -63.92 -45.23 90.2 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.205 -0.907 . . . . 0.43 109.931 176.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.417 ' HG3' ' O ' ' A' ' 42' ' ' SER . 83.3 mtp -61.89 -38.28 87.75 Favored 'General case' 0 C--O 1.196 -1.714 0 CA-C-N 115.931 -0.577 . . . . 1.49 110.258 176.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 23.8 tp10 -60.96 -35.2 76.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.806 0.842 . . . . 1.88 109.871 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.605 HG21 HD23 ' A' ' 14' ' ' LEU . 87.3 m -66.61 -57.33 7.44 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 107.566 -1.272 . . . . 0.45 107.566 -178.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.525 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.12 -43.61 74.26 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 113.725 -1.58 . . . . 0.27 109.567 177.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.93 -45.07 91.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 123.75 0.82 . . . . 0.33 113.038 -179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.462 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 84.1 mtt180 -66.47 -38.27 86.96 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.23 -0.441 . . . . 2.84 109.989 177.299 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.62 -38.05 89.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 115.872 -0.604 . . . . 0.9 109.926 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.525 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -57.29 -55.12 38.83 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 109.642 -0.503 . . . . 0.48 109.642 173.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 59.2 p -61.19 -38.06 85.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 123.679 0.612 . . . . 1.19 112.504 -177.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -71.01 -46.27 62.48 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 113.63 0.974 . . . . 3.07 113.63 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -101.74 -13.97 17.53 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 114.697 1.369 . . . . 1.01 114.697 -172.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.67 31.5 40.32 Favored Glycine 0 C--N 1.308 -0.986 0 C-N-CA 120.099 -1.048 . . . . 0.93 110.885 -178.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.48 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 4.1 p -97.09 135.31 31.68 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 N-CA-C 109.126 -0.694 . . . . 1.16 109.126 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 15.9 m -96.77 106.07 18.3 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 109.92 -0.4 . . . . 1.87 109.92 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.408 ' CD1' ' HB1' ' A' ' 49' ' ' ALA . 67.9 mt -102.19 117.45 61.25 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 110.362 -0.236 . . . . 0.57 110.362 -179.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -65.78 131.21 26.78 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.222 1.948 . . . . 0.87 110.329 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -51.88 -34.1 39.62 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 113.634 0.976 . . . . 1.83 113.634 -176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.634 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 3.4 m-20 -66.44 -45.62 79.22 Favored 'General case' 0 CA--C 1.495 -1.15 0 CA-C-O 120.566 0.222 . . . . 2.34 110.777 -178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 57.5 t -71.27 -31.68 44.67 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.538 -0.542 . . . . 0.66 109.538 -177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.82 -22.51 58.84 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.911 -0.586 . . . . 0.51 112.228 177.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.61 0.84 27.65 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 120.553 -0.832 . . . . 0.61 111.923 177.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 4.6 mmp_? -96.41 -15.11 21.98 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.185 -0.672 . . . . 3.98 109.185 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.525 HG21 HD23 ' A' ' 74' ' ' LEU . 19.5 m -76.85 91.84 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.433 -1.313 0 CA-C-O 122.559 1.171 . . . . 0.44 109.641 178.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.531 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 18.9 t70 -86.23 -35.57 19.94 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 114.417 -1.265 . . . . 1.91 111.375 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.479 HG22 ' HG2' ' A' ' 34' ' ' ARG . 45.0 p -113.75 149.17 41.33 Favored Pre-proline 0 C--N 1.284 -2.255 0 N-CA-C 109.355 -0.609 . . . . 0.47 109.355 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.477 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.6 Cg_exo -52.27 -39.99 71.01 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.561 2.841 . . . . 0.32 112.949 -178.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.9 ptp85 -50.86 -40.94 57.42 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 123.715 0.634 . . . . 1.48 112.52 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -64.01 -52.6 58.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.059 0.457 . . . . 2.13 110.802 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.585 HD12 HD11 ' A' ' 10' ' ' LEU . 3.5 tm? -67.86 -42.05 81.94 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.083 -0.962 . . . . 0.9 109.99 -176.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.404 ' HG ' ' OD1' ' A' ' 79' ' ' ASN . 32.9 tp -56.41 -57.02 14.08 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.524 -0.762 . . . . 0.34 109.321 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -58.73 -39.2 80.17 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.926 -0.579 . . . . 0.57 112.253 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.04 -46.45 89.49 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.214 0.53 . . . . 1.96 109.633 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 63.6 mt -78.44 -36.73 20.7 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 CA-C-N 116.069 -0.514 . . . . 0.55 110.292 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.404 ' OD1' ' HG ' ' A' ' 75' ' ' LEU . 11.4 m120 -56.96 -47.03 81.69 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.223 0.209 . . . . 1.14 110.95 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.53 -39.68 97.67 Favored Glycine 0 N--CA 1.447 -0.592 0 O-C-N 123.552 0.533 . . . . 0.53 112.155 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.03 -38.37 75.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.023 0.44 . . . . 0.6 110.518 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.9 mt -68.24 -33.97 75.36 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.97 -0.559 . . . . 1.42 110.691 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.66 -27.34 69.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 123.428 0.691 . . . . 0.85 111.917 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -84.33 -5.9 59.32 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 120.519 -0.473 . . . . 2.44 111.4 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -115.06 176.25 5.14 Favored 'General case' 0 N--CA 1.426 -1.63 0 N-CA-C 108.654 -0.869 . . . . 2.12 108.654 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.428 ' OXT' ' HA ' ' A' ' 1' ' ' MET . . . . . . . . 0 C--N 1.29 -2.009 0 N-CA-C 107.38 -1.341 . . . . 3.84 107.38 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 tpt . . . . . 0 CA--C 1.516 -0.333 0 N-CA-C 109.693 -0.484 . . . . 6.63 109.693 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.441 ' HB3' ' HE1' ' A' ' 56' ' ' TYR . . . -144.0 136.53 26.92 Favored 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 108.389 -0.967 . . . . 4.09 108.389 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.1 p -72.92 106.51 4.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 121.569 0.699 . . . . 2.77 110.164 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 72.71 173.77 0.3 Allowed 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 113.81 -1.541 . . . . 1.51 112.641 -179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.492 HD22 ' OD1' ' A' ' 9' ' ' ASP . 88.3 mt -126.52 147.45 49.84 Favored 'General case' 0 CA--C 1.488 -1.44 0 N-CA-C 108.672 -0.862 . . . . 0.8 108.672 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.8 p -99.43 172.78 7.11 Favored 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 107.372 -1.344 . . . . 0.63 107.372 174.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.708 HG21 ' HA ' ' A' ' 29' ' ' ASP . 21.0 m -58.9 -31.25 68.44 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.278 -0.638 . . . . 0.61 109.278 172.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -66.02 -50.68 63.37 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.356 -0.838 . . . . 1.65 111.716 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.492 ' OD1' HD22 ' A' ' 5' ' ' LEU . 15.4 t70 -68.44 -37.8 80.57 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 120.347 -0.541 . . . . 1.41 109.909 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 75' ' ' LEU . 18.4 tp -62.67 -42.95 99.89 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.28 -0.873 . . . . 0.48 108.984 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' HG23 ' A' ' 15' ' ' VAL . 42.2 ttp180 -50.35 -38.19 40.83 Favored 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 124.507 1.123 . . . . 2.46 111.12 178.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.694 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 59.6 ttt180 -56.25 -51.39 68.28 Favored 'General case' 0 C--O 1.216 -0.665 0 O-C-N 123.592 0.557 . . . . 3.93 110.724 179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.45 -37.17 84.85 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 123.379 0.424 . . . . 0.5 111.909 -174.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.52 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.84 -29.66 69.64 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 116.312 -0.404 . . . . 1.44 111.296 176.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 11' ' ' ARG . 61.8 t -77.67 -39.97 27.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 109.401 -0.592 . . . . 0.8 109.401 176.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.694 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 6.7 mm-40 -55.99 -53.18 60.01 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.015 0.926 . . . . 2.05 110.655 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -77.03 -18.45 58.11 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.552 -0.749 . . . . 1.39 111.866 -174.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.88 -51.66 6.25 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.004 0.43 . . . . 1.58 109.999 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 72.36 -89.27 0.51 Allowed Glycine 0 N--CA 1.435 -1.401 0 N-CA-C 109.87 -1.292 . . . . 2.32 109.87 -176.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -125.44 99.43 6.03 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-O 122.036 0.922 . . . . 5.17 110.852 177.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 32.3 m -133.66 -89.4 0.39 Allowed 'General case' 0 C--N 1.284 -2.248 0 N-CA-C 104.81 -2.293 . . . . 4.86 104.81 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -171.62 132.51 0.75 Allowed 'General case' 0 C--N 1.306 -1.291 0 C-N-CA 124.247 1.019 . . . . 4.5 108.288 170.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.69 78.89 1.29 Allowed Glycine 0 CA--C 1.455 -3.709 0 N-CA-C 108.634 -1.787 . . . . 2.77 108.634 175.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 m -69.36 73.78 0.34 Allowed 'General case' 0 N--CA 1.412 -2.374 0 CA-C-N 113.54 -1.33 . . . . 2.87 111.941 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.1 t70 61.57 39.01 15.14 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.435 1.494 . . . . 3.23 110.92 178.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.3 mp -77.85 -16.52 58.24 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.376 -0.829 . . . . 1.16 110.868 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 27.9 t -59.96 133.7 56.34 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.45 -0.795 . . . . 1.46 109.77 177.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 87.3 -106.87 3.21 Favored Glycine 0 N--CA 1.429 -1.791 0 N-CA-C 111.045 -0.822 . . . . 1.02 111.045 -176.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.708 ' HA ' HG21 ' A' ' 7' ' ' THR . 12.0 t70 -129.85 137.46 50.46 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.049 -1.093 . . . . 2.07 108.049 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.439 ' CZ ' ' HG ' ' A' ' 14' ' ' LEU . 11.8 p90 -137.66 20.13 2.89 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 120.793 -0.363 . . . . 0.44 110.177 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.743 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 75.7 mt -54.98 -22.42 15.19 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.15 0.796 . . . . 0.39 113.15 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -92.12 -14.59 28.94 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.733 0.813 . . . . 2.04 111.0 -176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 30' ' ' PHE . 4.0 mm? -80.11 131.77 35.81 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-N 115.891 -0.595 . . . . 1.37 109.978 -179.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.645 ' HD2' ' OD2' ' A' ' 69' ' ' ASP . 14.3 mmt180 -76.65 137.56 39.51 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 109.371 -0.603 . . . . 3.94 109.371 -178.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.639 ' HB3' ' HB3' ' A' ' 40' ' ' TYR . 47.2 m-85 -62.76 -37.72 87.74 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 107.638 -1.245 . . . . 0.35 107.638 175.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -55.45 -33.92 64.03 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 114.418 -1.265 . . . . 2.79 110.332 176.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -82.3 -35.08 28.34 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 115.983 -0.553 . . . . 0.88 110.617 -176.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.467 HG13 ' HB2' ' A' ' 40' ' ' TYR . 38.0 pt -90.44 16.14 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 C-N-CA 120.404 -0.518 . . . . 0.6 111.042 -178.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 28.74 73.91 Favored Glycine 0 C--O 1.238 0.39 0 CA-C-N 115.341 -0.845 . . . . 0.66 113.236 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.639 ' HB3' ' HB3' ' A' ' 35' ' ' PHE . 0.3 OUTLIER -97.37 114.03 25.78 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 109.469 -0.567 . . . . 1.33 109.469 -177.694 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -85.11 149.98 25.17 Favored 'General case' 0 CA--C 1.495 -1.161 0 CA-C-N 116.053 -0.521 . . . . 1.06 110.547 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 77.6 p -50.74 -33.94 25.09 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 113.916 1.08 . . . . 1.03 113.916 179.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.31 -49.42 69.55 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.841 -0.8 . . . . 1.56 108.841 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.07 -37.91 86.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.723 -0.671 . . . . 0.43 109.838 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.662 HD21 HG23 ' A' ' 68' ' ' VAL . 63.5 tp -62.95 -46.39 87.97 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.393 -0.821 . . . . 0.43 110.994 177.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 67.6 mtt -63.05 -36.56 83.99 Favored 'General case' 0 C--O 1.207 -1.179 0 N-CA-C 110.168 -0.308 . . . . 1.49 110.168 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 37.9 tt0 -64.55 -31.26 72.4 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-O 121.501 0.667 . . . . 1.88 110.831 176.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.52 HG21 HD13 ' A' ' 14' ' ' LEU . 96.8 m -66.06 -55.49 16.29 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.462 -1.31 . . . . 0.45 107.462 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.508 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -56.71 -38.63 72.59 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 113.909 -1.496 . . . . 0.27 109.795 175.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.45 -48.8 78.19 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 123.486 0.714 . . . . 0.33 111.63 179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 71.3 mtt180 -63.67 -39.38 94.2 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.365 -0.834 . . . . 2.84 109.933 179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 59.2 mt -65.36 -41.96 93.27 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.068 0.396 . . . . 0.9 112.068 176.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.8 mt-10 -57.59 -48.62 78.9 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 122.325 0.25 . . . . 0.48 110.544 175.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.5 m -63.43 -44.51 94.36 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 121.389 0.614 . . . . 1.19 111.428 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.3 ttt180 -65.99 -44.12 85.78 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.154 -0.93 . . . . 3.07 112.844 -176.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.441 ' HE1' ' HB3' ' A' ' 2' ' ' ALA . 80.0 m-85 -101.57 -18.59 15.85 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 115.296 1.591 . . . . 1.01 115.296 -177.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.84 62.37 1.77 Allowed Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.257 -0.973 . . . . 0.93 111.434 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.1 m -139.21 177.77 4.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 C-N-CA 123.523 0.729 . . . . 1.16 110.125 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 50.9 m -140.22 115.95 10.21 Favored 'General case' 0 N--CA 1.442 -0.856 0 O-C-N 123.632 0.583 . . . . 1.87 109.855 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.508 HD12 ' HB1' ' A' ' 49' ' ' ALA . 86.4 mt -101.01 130.31 25.34 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.461 -0.79 . . . . 0.57 110.294 -177.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -58.93 126.75 22.02 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 122.781 2.321 . . . . 0.87 111.647 176.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -51.35 -54.01 30.64 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.854 1.262 . . . . 1.83 113.658 -173.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.11 -28.45 63.29 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 116.235 -0.439 . . . . 2.34 111.66 -173.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.79 -37.62 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 108.462 -0.94 . . . . 0.66 108.462 177.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.93 -24.99 60.27 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.105 -0.952 . . . . 0.51 111.377 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.56 11.98 39.16 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 121.057 -0.592 . . . . 0.61 112.618 179.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.9 ttp85 -105.23 -21.62 13.22 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.378 0.608 . . . . 3.98 110.535 178.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.662 HG23 HD21 ' A' ' 45' ' ' LEU . 28.6 m -76.64 115.67 18.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 CA-C-O 121.597 0.713 . . . . 0.44 111.286 -176.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.645 ' OD2' ' HD2' ' A' ' 34' ' ' ARG . 33.3 t70 -97.79 -23.76 15.75 Favored 'General case' 0 CA--C 1.502 -0.893 0 CA-C-O 121.62 0.724 . . . . 1.91 110.533 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.431 HG22 ' HD3' ' A' ' 34' ' ' ARG . 70.7 p -116.75 143.97 32.45 Favored Pre-proline 0 N--CA 1.42 -1.941 0 CA-C-N 115.512 -0.767 . . . . 0.47 110.897 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.743 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 39.4 Cg_exo -59.36 -30.82 93.74 Favored 'Trans proline' 0 C--O 1.204 -1.204 0 C-N-CA 123.308 2.672 . . . . 0.32 112.352 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.553 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 6.0 ptp180 -54.75 -44.78 73.91 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 121.12 -0.232 . . . . 1.48 111.329 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -65.2 -46.19 81.71 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.197 0.522 . . . . 2.13 109.829 178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.461 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.1 -45.13 82.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.263 -0.881 . . . . 0.9 110.553 -176.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.515 ' HB2' HD22 ' A' ' 10' ' ' LEU . 61.8 tp -57.2 -54.19 49.59 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 109.454 -0.573 . . . . 0.34 109.454 176.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -59.99 -37.73 80.54 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 123.908 0.755 . . . . 0.57 111.804 -178.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.1 tp -60.92 -50.1 74.78 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 122.925 0.49 . . . . 1.96 110.522 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 54.8 mt -70.41 -31.13 45.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 N-CA-C 109.566 -0.531 . . . . 0.55 109.566 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.32 -39.61 93.62 Favored 'General case' 0 C--O 1.208 -1.093 0 CA-C-N 116.067 -0.515 . . . . 1.14 109.647 174.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.58 -38.9 93.7 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.857 -0.497 . . . . 0.53 111.857 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.84 -37.89 79.44 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.23 0.538 . . . . 0.6 110.194 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.7 mt -74.93 -20.92 59.49 Favored 'General case' 0 C--O 1.214 -0.796 0 CA-C-N 115.908 -0.587 . . . . 1.42 111.117 176.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.02 -27.15 67.18 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.027 0.441 . . . . 0.85 110.536 174.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -85.78 -22.39 27.71 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.434 0.635 . . . . 2.44 110.396 177.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.99 162.26 14.46 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.53 -0.759 . . . . 2.12 109.568 -179.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.291 -1.961 0 N-CA-C 107.503 -1.295 . . . . 3.84 107.503 178.955 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 C--O 1.237 0.431 0 N-CA-C 110.071 -0.344 . . . . 6.63 110.071 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.28 114.13 14.62 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 121.295 0.569 . . . . 4.09 110.834 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 15.1 t -147.23 131.16 17.14 Favored 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 106.29 -1.744 . . . . 2.77 106.29 177.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.434 ' HA ' HD13 ' A' ' 82' ' ' LEU . 11.7 tp -68.46 149.46 49.27 Favored 'General case' 0 N--CA 1.411 -2.391 0 CA-C-N 115.083 -0.962 . . . . 1.51 111.398 -172.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.601 ' HG ' HD11 ' A' ' 82' ' ' LEU . 79.8 mt -98.5 129.07 45.08 Favored 'General case' 0 N--CA 1.422 -1.863 0 CA-C-N 115.091 -0.959 . . . . 0.8 108.42 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -96.6 -171.97 2.39 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 107.144 -1.428 . . . . 0.63 107.144 173.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 m -56.73 -38.91 73.03 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.265 0.555 . . . . 0.61 110.218 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -74.79 -41.1 60.63 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 111.367 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -64.94 -36.03 83.07 Favored 'General case' 0 CA--C 1.496 -1.128 0 N-CA-C 108.896 -0.779 . . . . 1.41 108.896 179.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.475 HD11 ' CD1' ' A' ' 74' ' ' LEU . 19.7 tp -66.21 -50.88 62.32 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 114.829 -1.078 . . . . 0.48 108.474 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.414 ' O ' HG23 ' A' ' 15' ' ' VAL . 11.9 ttp180 -50.33 -42.13 52.38 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.82 0.7 . . . . 2.46 111.509 179.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 23.8 ttm180 -53.21 -47.04 69.25 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 123.727 0.642 . . . . 3.93 110.325 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.569 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -66.06 -42.83 88.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.696 -0.684 . . . . 0.5 112.085 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.65 HD13 HG21 ' A' ' 48' ' ' THR . 4.1 mm? -64.08 -34.79 78.84 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.008 0.433 . . . . 1.44 111.157 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 11' ' ' ARG . 95.1 t -69.55 -25.03 27.94 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.911 0 CA-C-O 120.997 0.427 . . . . 0.8 111.499 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.417 ' HA ' ' OE1' ' A' ' 16' ' ' GLU . 5.6 mm-40 -63.35 -45.96 88.76 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 121.174 0.511 . . . . 2.05 111.822 177.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 p -83.03 -20.97 34.01 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.443 0.64 . . . . 1.39 110.919 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.556 ' HB2' ' OH ' ' A' ' 40' ' ' TYR . . . -74.5 -18.57 60.59 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.689 -0.687 . . . . 1.58 111.437 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.55 -95.19 0.44 Allowed Glycine 0 C--O 1.222 -0.596 0 N-CA-C 111.125 -0.79 . . . . 2.32 111.125 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -82.97 25.88 0.65 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.448 0.642 . . . . 5.17 110.463 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.567 HG22 ' HA ' ' A' ' 25' ' ' ASP . 6.2 m 62.06 38.99 13.6 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.37 1.068 . . . . 4.86 109.792 -176.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -61.23 146.33 48.16 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 114.844 -1.071 . . . . 4.5 109.088 175.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 113.74 22.49 5.36 Favored Glycine 0 N--CA 1.416 -2.698 0 N-CA-C 109.417 -1.473 . . . . 2.77 109.417 -173.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.1 p 66.96 19.89 10.54 Favored 'General case' 0 C--O 1.247 0.947 0 C-N-CA 126.203 1.801 . . . . 2.87 112.722 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.567 ' HA ' HG22 ' A' ' 21' ' ' THR . 14.9 t70 61.29 130.38 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.379 1.071 . . . . 3.23 111.39 -172.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -110.97 24.91 12.35 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.784 -0.572 . . . . 1.16 111.813 -173.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.7 t -61.29 113.51 2.66 Favored 'General case' 0 C--O 1.251 1.18 0 CA-C-O 121.037 0.446 . . . . 1.46 110.587 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.72 -140.89 15.59 Favored Glycine 0 N--CA 1.429 -1.795 0 N-CA-C 110.802 -0.919 . . . . 1.02 110.802 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -102.49 124.78 48.67 Favored 'General case' 0 C--N 1.304 -1.412 0 N-CA-C 108.939 -0.763 . . . . 2.07 108.939 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.3 p90 -133.52 14.73 4.08 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.104 -0.638 . . . . 0.44 111.17 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.777 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 42.4 mt -52.86 -31.96 42.21 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 114.071 1.137 . . . . 0.39 114.071 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -94.29 -7.42 41.98 Favored 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 116.276 -0.42 . . . . 2.04 111.86 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.8 mp -84.84 123.58 30.62 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.741 -1.207 . . . . 1.37 107.741 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -73.95 145.65 44.53 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 109.71 -0.478 . . . . 3.94 109.71 -177.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.545 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 51.9 m-85 -61.49 -36.42 80.43 Favored 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 109.368 -0.605 . . . . 0.35 109.368 178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -56.28 -36.78 68.99 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.318 -0.856 . . . . 2.79 110.726 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.9 -35.43 37.96 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.837 -0.62 . . . . 0.88 110.141 -175.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -93.27 12.91 2.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 113.267 0.84 . . . . 0.6 113.267 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.49 41.11 30.91 Favored Glycine 0 CA--C 1.524 0.614 0 C-N-CA 121.051 -0.595 . . . . 0.66 114.27 174.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.556 ' OH ' ' HB2' ' A' ' 18' ' ' ALA . 13.7 m-85 -116.95 110.23 18.03 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 122.625 0.37 . . . . 1.33 110.724 176.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -88.46 155.09 19.86 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 120.562 -0.455 . . . . 1.06 110.313 174.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.416 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 79.4 p -51.94 -33.42 37.31 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 114.315 1.228 . . . . 1.03 114.315 -177.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 40.8 tp -65.26 -51.78 58.61 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.886 -0.413 . . . . 1.56 109.886 -178.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.97 -39.49 89.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.498 0.666 . . . . 0.43 110.058 175.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.515 ' O ' ' HB ' ' A' ' 48' ' ' THR . 60.0 tp -62.37 -47.55 83.66 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.138 -0.937 . . . . 0.43 110.945 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 42' ' ' SER . 62.1 mtm -63.87 -37.23 86.61 Favored 'General case' 0 C--O 1.204 -1.33 0 O-C-N 122.443 -0.161 . . . . 1.49 110.796 177.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.636 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 40.2 tt0 -62.2 -31.43 71.95 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-O 121.49 0.662 . . . . 1.88 109.912 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.65 HG21 HD13 ' A' ' 14' ' ' LEU . 65.2 m -66.67 -56.9 8.49 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 107.591 -1.263 . . . . 0.45 107.591 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.506 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.34 -35.48 69.95 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 114.384 -1.28 . . . . 0.27 110.553 176.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.47 -44.05 84.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.411 0.684 . . . . 0.33 111.933 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.636 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 44.2 mtt180 -64.78 -37.12 86.54 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-N 115.303 -0.862 . . . . 2.84 109.412 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 13' ' ' ALA . 98.2 mt -67.62 -45.86 74.21 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.21 -0.905 . . . . 0.9 111.286 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 48.2 mt-10 -54.43 -51.99 63.21 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 123.093 0.557 . . . . 0.48 110.214 178.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 m -61.91 -48.85 78.6 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 114.943 -1.026 . . . . 1.19 111.829 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.46 HH11 ' HD3' ' A' ' 55' ' ' ARG . 12.0 ttm180 -65.6 -48.65 71.57 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.392 0.515 . . . . 3.07 112.392 -178.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -91.86 2.57 56.44 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.215 0.82 . . . . 1.01 113.215 -171.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 63.71 56.5 18.74 Favored Glycine 0 C--O 1.25 1.102 0 CA-C-N 116.163 -0.471 . . . . 0.93 112.265 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.482 HG22 ' H ' ' A' ' 59' ' ' SER . 8.7 p -138.68 176.25 6.82 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.978 0 N-CA-C 107.962 -1.125 . . . . 1.16 107.962 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.482 ' H ' HG22 ' A' ' 58' ' ' VAL . 68.8 m -141.17 138.89 33.72 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 109.606 -0.516 . . . . 1.87 109.606 178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.506 HD12 ' HB1' ' A' ' 49' ' ' ALA . 65.6 mt -130.62 120.99 18.96 Favored Pre-proline 0 C--N 1.308 -1.223 0 N-CA-C 108.638 -0.875 . . . . 0.57 108.638 -177.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.416 ' HB2' HG23 ' A' ' 64' ' ' VAL . 38.1 Cg_exo -62.2 124.72 14.88 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.581 2.187 . . . . 0.87 110.175 176.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.408 ' HB2' ' SD ' ' A' ' 46' ' ' MET . 5.4 p-10 -51.66 -31.53 25.98 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.713 1.205 . . . . 1.83 112.946 -177.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -69.02 -38.41 79.2 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.934 0.397 . . . . 2.34 110.546 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' A' ' 61' ' ' PRO . 21.3 t -75.59 -41.8 41.55 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.0 -1.111 . . . . 0.66 108.0 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.37 -28.16 66.62 Favored 'General case' 0 C--O 1.216 -0.678 0 CA-C-N 115.639 -0.71 . . . . 0.51 111.689 176.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -100.42 10.77 59.68 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 121.005 -0.617 . . . . 0.61 112.036 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.1 ttm180 -101.3 -24.39 14.23 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.837 -0.801 . . . . 3.98 108.837 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.568 HG21 HD23 ' A' ' 74' ' ' LEU . 30.3 m -79.14 97.55 2.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 CA-C-O 122.245 1.022 . . . . 0.44 110.775 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -88.02 -21.01 25.03 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.273 -0.876 . . . . 1.91 111.221 -176.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 43.7 p -121.39 142.87 36.31 Favored Pre-proline 0 N--CA 1.413 -2.319 0 CA-C-N 115.998 -0.546 . . . . 0.47 109.572 179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.777 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.7 Cg_exo -53.24 -34.9 71.8 Favored 'Trans proline' 0 CA--C 1.514 -0.478 0 C-N-CA 123.616 2.877 . . . . 0.32 113.34 -178.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.7 ptp85 -52.79 -44.22 66.43 Favored 'General case' 0 CA--C 1.547 0.849 0 O-C-N 123.475 0.485 . . . . 1.48 110.878 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.43 ' HB3' HG12 ' A' ' 68' ' ' VAL . 60.9 mm-40 -65.46 -47.96 74.33 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.262 0.625 . . . . 2.13 110.516 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.568 HD23 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -66.99 -42.93 84.22 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.323 -0.853 . . . . 0.9 110.333 -176.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 51.1 tp -58.33 -50.2 74.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.636 -0.505 . . . . 0.34 109.636 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -59.42 -41.77 90.3 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.545 0.738 . . . . 0.57 111.094 -179.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.97 -57.18 14.23 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.029 0.932 . . . . 1.96 108.738 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.3 mt -68.64 -31.85 52.7 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.51 0 CA-C-N 115.699 -0.682 . . . . 0.55 111.425 -176.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.77 -44.32 93.93 Favored 'General case' 0 N--CA 1.481 1.114 0 O-C-N 122.187 -0.32 . . . . 1.14 110.505 175.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.72 -39.58 90.21 Favored Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.378 -0.689 . . . . 0.53 111.378 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.62 -35.33 75.16 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.64 0.376 . . . . 0.6 111.455 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.601 HD11 ' HG ' ' A' ' 5' ' ' LEU . 55.6 mt -68.67 -31.96 71.46 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 122.927 0.491 . . . . 1.42 111.861 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.75 -19.13 64.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.217 0.532 . . . . 0.85 111.294 177.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -129.07 29.27 5.2 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.115 -0.493 . . . . 2.44 109.965 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.419 ' HB2' ' HA ' ' A' ' 82' ' ' LEU . . . -78.72 105.95 10.37 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.115 0.483 . . . . 2.12 110.025 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.296 -1.754 0 N-CA-C 108.271 -1.011 . . . . 3.84 108.271 -179.477 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.9 mmm . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 110.31 -0.256 . . . . 6.63 110.31 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.458 ' HB1' HD22 ' A' ' 82' ' ' LEU . . . -78.62 126.17 30.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.03 0.443 . . . . 4.09 110.795 179.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.637 ' HB ' ' HE1' ' A' ' 56' ' ' TYR . 6.9 m -85.86 116.79 24.32 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-O 121.721 0.772 . . . . 2.77 108.944 178.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 13.3 tp -72.09 151.31 43.16 Favored 'General case' 0 N--CA 1.405 -2.718 0 CA-C-N 114.787 -1.097 . . . . 1.51 109.928 -176.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.474 HD21 ' CE2' ' A' ' 56' ' ' TYR . 87.5 mt -93.97 130.09 40.21 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.225 -0.898 . . . . 0.8 112.076 -174.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 51.0 p -99.01 -173.83 2.61 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 106.478 -1.675 . . . . 0.63 106.478 166.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.6 m -56.72 -46.72 81.14 Favored 'General case' 0 C--O 1.215 -0.753 0 CA-C-N 118.589 0.631 . . . . 0.61 109.866 174.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.27 -39.83 93.12 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.596 0.591 . . . . 1.65 112.596 -179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -65.14 -39.97 93.76 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 109.034 -0.728 . . . . 1.41 109.034 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.441 HD11 HD12 ' A' ' 74' ' ' LEU . 19.7 tp -66.17 -51.93 53.03 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 114.927 -1.033 . . . . 0.48 108.294 178.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 15' ' ' VAL . 37.7 ttm180 -46.98 -47.37 21.94 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.251 1.42 . . . . 2.46 111.498 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.589 ' HD2' HH22 ' A' ' 55' ' ' ARG . 29.1 ttm180 -56.39 -48.92 75.91 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 123.857 0.723 . . . . 3.93 110.291 -178.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.21 -37.98 89.4 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.836 -0.62 . . . . 0.5 111.095 -179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.432 HD13 HG21 ' A' ' 48' ' ' THR . 4.4 mm? -62.93 -45.12 93.97 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.054 -0.351 . . . . 1.44 110.054 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.534 HG22 ' HA3' ' A' ' 23' ' ' GLY . 85.5 t -60.0 -52.39 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 N-CA-C 109.73 -0.47 . . . . 0.8 109.73 177.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.409 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.0 mt-10 -57.55 -41.82 81.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.16 -0.473 . . . . 2.05 111.677 -178.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.541 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 15.0 m -77.26 -32.76 55.87 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 112.038 0.385 . . . . 1.39 112.038 -177.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -78.45 -19.65 52.69 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.344 0.592 . . . . 1.58 110.506 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 128.71 119.77 2.21 Favored Glycine 0 N--CA 1.428 -1.866 0 N-CA-C 110.03 -1.228 . . . . 2.32 110.03 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -5.46 1.86 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 115.357 1.614 . . . . 5.17 115.357 -176.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 t -70.83 -54.23 12.34 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 116.218 -0.446 . . . . 4.86 110.189 175.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.62 126.5 16.24 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.673 -0.862 . . . . 4.5 108.673 -175.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.534 ' HA3' HG22 ' A' ' 15' ' ' VAL . . . -91.99 51.33 2.85 Favored Glycine 0 CA--C 1.477 -2.309 0 C-N-CA 120.777 -0.725 . . . . 2.77 113.126 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.477 ' HB ' ' CD2' ' A' ' 26' ' ' LEU . 7.8 m 44.91 -116.74 0.55 Allowed 'General case' 0 CA--C 1.562 1.417 0 C-N-CA 124.605 1.162 . . . . 2.87 112.388 172.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -122.36 28.75 7.27 Favored 'General case' 0 C--N 1.289 -2.06 0 C-N-CA 123.494 0.718 . . . . 3.23 110.521 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.477 ' CD2' ' HB ' ' A' ' 24' ' ' THR . 2.4 mm? -87.45 2.6 50.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.511 0.93 . . . . 1.16 113.511 -175.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.3 t -72.84 130.07 39.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.15 -1.055 . . . . 1.46 108.15 177.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 93.39 -168.58 29.66 Favored Glycine 0 N--CA 1.43 -1.757 0 N-CA-C 109.299 -1.52 . . . . 1.02 109.299 -175.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -92.73 142.35 27.46 Favored 'General case' 0 C--N 1.29 -2.01 0 N-CA-C 107.547 -1.279 . . . . 2.07 107.547 178.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.448 ' HA ' HD13 ' A' ' 33' ' ' LEU . 30.9 p90 -135.12 15.55 3.51 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.284 -0.566 . . . . 0.44 111.863 -174.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.59 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 65.0 mt -52.87 -24.86 9.97 Favored 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 116.115 1.895 . . . . 0.39 116.115 -175.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -95.21 -12.25 26.63 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-N 118.057 0.39 . . . . 2.04 111.798 178.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.448 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.3 mp -81.17 119.77 24.01 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.421 -0.585 . . . . 1.37 109.421 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.28 141.55 41.63 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.298 -1.001 . . . . 3.94 108.298 -178.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.5 m-85 -58.6 -37.95 76.95 Favored 'General case' 0 C--N 1.316 -0.891 0 O-C-N 123.47 0.481 . . . . 0.35 111.409 -176.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.49 -33.81 64.03 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.37 0.668 . . . . 2.79 111.364 177.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -82.62 -31.74 28.68 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.88 110.74 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.416 HG13 ' HD1' ' A' ' 40' ' ' TYR . 24.0 pt -93.16 22.52 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 N-CA-C 112.436 0.532 . . . . 0.6 112.436 -177.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.69 35.4 55.15 Favored Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.878 -0.601 . . . . 0.66 113.961 173.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.489 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 14.4 m-85 -108.24 116.9 32.82 Favored 'General case' 0 C--N 1.299 -1.615 0 N-CA-C 112.582 0.586 . . . . 1.33 112.582 178.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -82.68 147.01 28.75 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 106.687 -1.597 . . . . 1.06 106.687 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.8 p -53.3 -35.93 60.65 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 113.754 1.02 . . . . 1.03 113.754 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -67.41 -46.93 71.75 Favored 'General case' 0 C--O 1.222 -0.361 0 N-CA-C 109.273 -0.64 . . . . 1.56 109.273 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -61.45 -33.59 74.0 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 121.524 0.678 . . . . 0.43 110.33 176.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.414 ' O ' ' HB ' ' A' ' 48' ' ' THR . 51.4 tp -63.75 -51.27 65.65 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.436 -0.802 . . . . 0.43 109.95 175.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.5 mtm -63.79 -30.84 71.89 Favored 'General case' 0 C--O 1.206 -1.224 0 CA-C-N 116.36 -0.382 . . . . 1.49 111.227 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.446 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 8.5 tp10 -60.96 -37.89 83.98 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.551 1.14 . . . . 1.88 109.325 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.541 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 71.7 m -67.19 -56.7 8.83 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 113.998 -1.455 . . . . 0.45 107.953 -178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.525 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -56.69 -34.99 67.94 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 114.39 -1.277 . . . . 0.27 110.419 176.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.451 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -59.16 -41.93 89.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.303 0.641 . . . . 0.33 111.549 179.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.2 mtt180 -64.86 -42.0 95.23 Favored 'General case' 0 C--O 1.198 -1.617 0 CA-C-N 115.792 -0.64 . . . . 2.84 109.33 176.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 49' ' ' ALA . 91.6 mt -61.71 -41.66 97.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.239 -0.437 . . . . 0.9 110.456 -179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.0 mt-10 -57.13 -56.38 22.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.878 -0.601 . . . . 0.48 110.139 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.5 t -62.77 -50.68 70.07 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.032 -0.986 . . . . 1.19 111.374 -177.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.589 HH22 ' HD2' ' A' ' 12' ' ' ARG . 65.4 ttt180 -63.26 -44.28 95.6 Favored 'General case' 0 C--N 1.313 -0.993 0 C-N-CA 125.05 1.34 . . . . 3.07 113.301 -175.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.637 ' HE1' ' HB ' ' A' ' 3' ' ' THR . 92.4 m-85 -97.07 -12.53 23.07 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.612 -0.835 . . . . 1.01 113.178 -176.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 56.65 2.95 Favored Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.109 -1.043 . . . . 0.93 110.594 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.473 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 12.6 p -139.51 176.3 6.06 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.676 -1.231 . . . . 1.16 107.676 -178.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 58' ' ' VAL . 8.1 t -141.96 136.23 30.15 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 107.973 -1.121 . . . . 1.87 107.973 177.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.429 HD12 ' HB1' ' A' ' 49' ' ' ALA . 69.2 mt -124.14 126.57 25.55 Favored Pre-proline 0 C--N 1.32 -0.684 0 N-CA-C 110.328 -0.249 . . . . 0.57 110.328 -175.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -59.2 131.45 41.3 Favored 'Trans proline' 0 C--O 1.247 0.96 0 C-N-CA 122.836 2.357 . . . . 0.87 111.573 175.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -53.26 -40.65 64.78 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.935 1.294 . . . . 1.83 112.496 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 14.9 t70 -66.31 -40.89 90.27 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.111 -0.495 . . . . 2.34 111.002 -178.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 55.2 t -72.63 -40.04 61.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 109.229 -0.656 . . . . 0.66 109.229 -178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.47 -31.3 65.82 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.528 -0.76 . . . . 0.51 111.696 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.44 11.47 39.45 Favored Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.629 -0.796 . . . . 0.61 112.506 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 63' ' ' ASP . 11.3 tpt180 -97.14 -20.0 18.27 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.698 0.761 . . . . 3.98 109.841 -177.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.521 HG21 HD23 ' A' ' 74' ' ' LEU . 24.3 m -79.2 117.11 24.27 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 CA-C-N 115.093 -0.958 . . . . 0.44 112.229 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -94.4 -39.05 10.66 Favored 'General case' 0 CA--C 1.477 -1.864 0 CA-C-N 115.506 -0.77 . . . . 1.91 110.677 175.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.415 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 47.0 p -104.65 136.91 19.11 Favored Pre-proline 0 N--CA 1.407 -2.589 0 CA-C-N 115.723 -0.671 . . . . 0.47 111.112 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.59 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.8 Cg_exo -52.17 -35.69 63.86 Favored 'Trans proline' 0 CA--C 1.516 -0.411 0 C-N-CA 124.079 3.186 . . . . 0.32 113.787 -179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -53.42 -42.66 67.26 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.851 0.315 . . . . 1.48 111.851 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -65.14 -46.01 82.68 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 123.184 0.594 . . . . 2.13 110.55 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.521 HD23 HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -65.84 -48.74 70.6 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.11 -0.95 . . . . 0.9 109.411 -178.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.01 -54.59 45.06 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.705 -0.68 . . . . 0.34 110.922 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.12 -40.61 98.11 Favored 'General case' 0 C--O 1.247 0.957 0 N-CA-C 112.626 0.602 . . . . 0.57 112.626 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.23 -48.65 80.5 Favored 'General case' 0 C--O 1.243 0.73 0 N-CA-C 108.86 -0.793 . . . . 1.96 108.86 179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 65.9 mt -67.16 -35.16 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.777 0 CA-C-N 116.074 -0.512 . . . . 0.55 110.702 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -57.41 -43.45 83.77 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 110.124 -0.324 . . . . 1.14 110.124 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.48 -40.22 97.52 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.825 -0.625 . . . . 0.53 111.919 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.5 -41.99 71.91 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.104 0.478 . . . . 0.6 111.032 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.458 HD22 ' HB1' ' A' ' 2' ' ' ALA . 62.5 mt -66.32 -31.43 72.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.831 -0.622 . . . . 1.42 111.855 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -60.84 -24.5 65.93 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.966 0.412 . . . . 0.85 111.688 -179.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -81.09 -3.16 51.06 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 112.075 0.398 . . . . 2.44 112.075 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -130.42 9.42 5.13 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.904 0.859 . . . . 2.12 110.04 178.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.309 -1.189 0 CA-C-N 115.643 -0.708 . . . . 3.84 109.106 -179.313 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? . . . . . 0 C--O 1.245 0.836 0 N-CA-C 109.471 -0.566 . . . . 6.63 109.471 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 57.84 76.44 0.33 Allowed 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 123.685 0.794 . . . . 4.09 110.469 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 9.0 t -105.27 122.08 45.2 Favored 'General case' 0 N--CA 1.42 -1.964 0 CA-C-N 115.693 -0.685 . . . . 2.77 109.672 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.7 mp -63.77 125.85 25.69 Favored 'General case' 0 CA--C 1.487 -1.472 0 CA-C-N 115.459 -0.791 . . . . 1.51 109.813 176.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.528 ' H ' HD22 ' A' ' 5' ' ' LEU . 1.4 mm? -71.62 139.41 49.3 Favored 'General case' 0 N--CA 1.412 -2.352 0 CA-C-N 114.763 -1.108 . . . . 0.8 109.732 -176.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.7 p -97.64 -170.69 2.04 Favored 'General case' 0 N--CA 1.419 -1.985 0 N-CA-C 105.181 -2.155 . . . . 0.63 105.181 167.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.836 HG21 ' HA ' ' A' ' 29' ' ' ASP . 41.8 m -56.92 -47.54 80.37 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 119.244 0.929 . . . . 0.61 110.123 176.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -57.8 -48.36 79.94 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.977 -0.556 . . . . 1.65 112.387 179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.441 ' HB3' HD12 ' A' ' 5' ' ' LEU . 16.2 m-20 -66.15 -38.6 88.5 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.134 -0.484 . . . . 1.41 110.484 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.426 HD22 HD13 ' A' ' 75' ' ' LEU . 16.5 tp -66.95 -46.8 73.58 Favored 'General case' 0 N--CA 1.435 -1.176 0 N-CA-C 108.4 -0.963 . . . . 0.48 108.4 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.407 ' O ' HG23 ' A' ' 15' ' ' VAL . 41.1 ttp180 -53.54 -46.48 70.2 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 123.792 0.837 . . . . 2.46 110.858 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.412 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 45.5 ttt180 -54.33 -50.55 67.13 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.391 0.432 . . . . 3.93 110.251 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.42 -40.65 95.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 115.752 -0.658 . . . . 0.5 111.351 -177.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.412 ' HB3' ' OH ' ' A' ' 40' ' ' TYR . 10.2 mp -64.21 -44.03 93.18 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.875 -0.33 . . . . 1.44 111.786 177.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 11' ' ' ARG . 96.9 t -60.93 -45.42 98.38 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 N-CA-C 109.928 -0.397 . . . . 0.8 109.928 178.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.412 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 42.3 mt-10 -60.58 -47.52 85.84 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.104 -0.498 . . . . 2.05 110.955 178.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.539 ' HA ' ' CZ ' ' A' ' 51' ' ' ARG . 38.9 m -65.38 -38.64 90.63 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.642 -0.708 . . . . 1.39 112.484 -177.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.85 -46.36 78.8 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.383 -0.599 . . . . 1.58 109.383 178.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.15 -17.33 58.52 Favored Glycine 0 N--CA 1.441 -1.002 0 CA-C-N 115.423 -0.808 . . . . 2.32 112.581 177.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -76.43 173.76 11.09 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 122.721 0.408 . . . . 5.17 111.653 -178.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.2 m -69.3 -92.78 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.842 -0.617 . . . . 4.86 112.294 -174.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -91.52 146.23 23.96 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.667 -0.864 . . . . 4.5 108.667 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.47 79.16 0.57 Allowed Glycine 0 N--CA 1.418 -2.517 0 CA-C-O 119.063 -0.854 . . . . 2.77 111.642 -177.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.8 p 37.19 -116.1 0.13 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.228 1.411 . . . . 2.87 113.122 174.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -118.94 17.46 13.36 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 106.567 -1.642 . . . . 3.23 106.567 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.498 ' CD1' HD12 ' A' ' 38' ' ' ILE . 16.4 tp -66.47 -27.13 67.57 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.54 -1.664 . . . . 1.16 109.412 -179.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.0 t -76.88 97.67 4.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.164 0.983 . . . . 1.46 110.887 -177.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 169.24 -166.6 39.82 Favored Glycine 0 N--CA 1.428 -1.869 0 N-CA-C 106.521 -2.632 . . . . 1.02 106.521 177.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.836 ' HA ' HG21 ' A' ' 7' ' ' THR . 11.5 t70 -85.66 97.8 10.32 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.101 -1.815 . . . . 2.07 106.101 173.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 14.6 p90 -110.46 25.57 11.64 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.706 -0.679 . . . . 0.44 112.35 -169.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.78 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 50.6 mt -50.36 -27.75 6.84 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 116.061 1.874 . . . . 0.39 116.061 -176.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -97.58 -5.19 36.18 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 118.43 0.559 . . . . 2.04 112.061 -177.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.431 HD23 HG21 ' A' ' 38' ' ' ILE . 9.4 mp -77.18 125.14 28.84 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.525 -0.734 . . . . 1.37 111.115 -177.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.442 ' HG3' ' OD2' ' A' ' 69' ' ' ASP . 10.4 mpt_? -73.74 129.62 38.29 Favored 'General case' 0 C--O 1.247 0.951 0 N-CA-C 108.438 -0.949 . . . . 3.94 108.438 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.473 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 80.6 m-85 -55.05 -50.37 69.27 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 124.296 0.997 . . . . 0.35 113.399 -173.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -53.51 -27.04 23.43 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 113.179 0.807 . . . . 2.79 113.179 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -82.78 -33.05 27.44 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.371 0.605 . . . . 0.88 110.187 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.498 HD12 ' CD1' ' A' ' 26' ' ' LEU . 12.6 pt -96.75 22.81 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 112.958 0.725 . . . . 0.6 112.958 -175.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.17 21.77 54.02 Favored Glycine 0 CA--C 1.506 -0.483 0 CA-C-N 115.799 -0.637 . . . . 0.66 113.997 174.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.473 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 26.6 m-85 -123.06 102.6 8.08 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 112.023 0.379 . . . . 1.33 112.023 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -82.34 147.22 28.96 Favored 'General case' 0 C--N 1.286 -2.181 0 N-CA-C 106.914 -1.513 . . . . 1.06 106.914 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.581 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 23.8 m -50.01 -22.44 1.59 Allowed 'General case' 0 CA--C 1.564 1.482 0 N-CA-C 113.839 1.051 . . . . 1.03 113.839 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.4 tp -64.57 -58.76 5.46 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.764 -0.585 . . . . 1.56 110.006 172.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -62.68 -26.83 68.86 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.645 0.736 . . . . 0.43 109.86 176.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.581 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 28.8 tp -64.28 -47.23 80.32 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 115.393 -0.821 . . . . 0.43 110.251 176.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.579 ' HG3' ' O ' ' A' ' 42' ' ' SER . 56.0 mtm -63.58 -33.12 74.89 Favored 'General case' 0 C--O 1.193 -1.879 0 N-CA-C 110.051 -0.352 . . . . 1.49 110.051 176.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.496 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 10.9 tp10 -60.55 -37.82 82.48 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-O 121.957 0.884 . . . . 1.88 109.349 176.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.468 ' HA ' ' OG ' ' A' ' 17' ' ' SER . 79.4 m -70.14 -55.98 8.03 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.319 -1.309 . . . . 0.45 107.866 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.652 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -54.9 -36.03 64.76 Favored 'General case' 0 C--O 1.203 -1.356 0 CA-C-N 114.0 -1.455 . . . . 0.27 110.809 178.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.37 -43.52 83.62 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-O 121.538 0.685 . . . . 0.33 112.015 179.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.539 ' CZ ' ' HA ' ' A' ' 17' ' ' SER . 77.6 mtt180 -68.9 -37.83 79.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.279 -0.873 . . . . 2.84 109.599 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.652 HD12 ' HA ' ' A' ' 49' ' ' ALA . 56.8 mt -62.75 -46.32 88.6 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 114.903 -1.044 . . . . 0.9 109.557 176.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 46.6 mt-10 -55.98 -58.06 9.49 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.606 -0.725 . . . . 0.48 111.218 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.0 t -63.13 -56.37 17.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.38 -0.827 . . . . 1.19 112.284 -174.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.548 ' HD2' ' CZ ' ' A' ' 56' ' ' TYR . 35.5 ttm180 -65.02 -43.82 91.18 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.769 0.655 . . . . 3.07 112.769 -173.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.548 ' CZ ' ' HD2' ' A' ' 55' ' ' ARG . 61.7 m-85 -98.04 -3.26 38.45 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.175 -0.61 . . . . 1.01 112.514 -173.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 72.62 43.42 43.87 Favored Glycine 0 C--N 1.318 -0.425 0 C-N-CA 120.645 -0.788 . . . . 0.93 112.822 176.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.416 ' CG1' ' HA ' ' A' ' 53' ' ' GLU . 11.4 p -114.91 143.15 25.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 N-CA-C 109.421 -0.585 . . . . 1.16 109.421 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.9 m -99.74 120.35 39.58 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 109.126 -0.694 . . . . 1.87 109.126 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.1 mt -126.56 107.39 23.4 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 109.434 -0.58 . . . . 0.57 109.434 179.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -58.68 141.75 97.92 Favored 'Trans proline' 0 C--O 1.242 0.691 0 C-N-CA 122.324 2.016 . . . . 0.87 110.97 176.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -52.2 -39.84 60.72 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.432 1.093 . . . . 1.83 112.465 -175.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.687 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 32.8 t70 -69.01 -38.81 79.45 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.58 -0.282 . . . . 2.34 110.88 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 98.6 t -69.97 -38.29 74.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.897 -0.779 . . . . 0.66 108.897 -178.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.02 -21.42 59.03 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.58 -0.736 . . . . 0.51 111.819 176.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -111.3 7.74 28.69 Favored Glycine 0 N--CA 1.442 -0.941 0 C-N-CA 121.162 -0.542 . . . . 0.61 112.219 178.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.687 ' HG2' ' O ' ' A' ' 63' ' ' ASP . 24.3 mmm180 -101.31 -15.55 17.22 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-O 121.541 0.686 . . . . 3.98 109.958 177.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.579 HG23 HD21 ' A' ' 45' ' ' LEU . 30.9 m -78.07 101.39 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.565 0 CA-C-O 122.456 1.122 . . . . 0.44 109.42 178.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.461 ' OD2' HG23 ' A' ' 70' ' ' THR . 8.5 t70 -88.2 -25.76 22.74 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.041 -1.436 . . . . 1.91 111.262 -177.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.461 HG23 ' OD2' ' A' ' 69' ' ' ASP . 30.1 p -133.62 147.39 64.39 Favored Pre-proline 0 N--CA 1.422 -1.838 0 CA-C-N 115.432 -0.804 . . . . 0.47 108.944 -178.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.78 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 57.1 Cg_exo -55.7 -35.77 93.8 Favored 'Trans proline' 0 C--O 1.208 -0.98 0 C-N-CA 123.302 2.668 . . . . 0.32 112.037 177.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.579 ' HB3' ' HB3' ' A' ' 31' ' ' LEU . 9.8 ptm180 -54.33 -39.8 67.4 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 123.209 0.318 . . . . 1.48 111.615 176.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -67.33 -48.78 66.52 Favored 'General case' 0 C--N 1.345 0.371 0 CA-C-O 121.544 0.688 . . . . 2.13 110.693 174.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.529 HD23 HG21 ' A' ' 68' ' ' VAL . 3.2 tm? -66.35 -48.19 71.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.636 -1.165 . . . . 0.9 111.682 -174.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' ' 5' ' ' LEU . 31.3 tp -57.02 -47.53 80.67 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 123.027 0.531 . . . . 0.34 109.709 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.21 -43.18 96.17 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.055 -0.975 . . . . 0.57 111.303 179.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.42 -48.82 79.45 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.793 -0.639 . . . . 1.96 109.536 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.418 ' CD1' HD13 ' A' ' 52' ' ' LEU . 49.1 mt -65.76 -43.08 93.57 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 N-CA-C 110.359 -0.237 . . . . 0.55 110.359 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.06 -43.01 91.67 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 120.785 -0.366 . . . . 1.14 110.445 177.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.7 -40.05 93.83 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 116.056 -0.52 . . . . 0.53 112.301 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.21 -43.18 71.22 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.076 0.465 . . . . 0.6 110.518 179.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 29.9 mt -70.3 -16.53 63.02 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.083 -0.508 . . . . 1.42 112.001 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.06 -21.99 66.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.865 0.364 . . . . 0.85 110.688 175.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -86.58 -11.48 51.4 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.428 -0.351 . . . . 2.44 111.111 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.62 79.09 5.05 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 121.941 0.877 . . . . 2.12 110.294 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.42 -1.947 0 N-CA-C 106.391 -1.707 . . . . 3.84 106.391 179.966 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.7 mtp . . . . . 0 CA--C 1.501 -0.906 0 N-CA-C 108.836 -0.802 . . . . 6.63 108.836 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.38 97.68 6.02 Favored 'General case' 0 N--CA 1.432 -1.363 0 C-N-CA 120.326 -0.55 . . . . 4.09 110.395 178.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.618 ' HB ' ' HE1' ' A' ' 56' ' ' TYR . 21.6 m -77.87 106.63 9.84 Favored 'General case' 0 CA--C 1.491 -1.326 0 N-CA-C 106.681 -1.6 . . . . 2.77 106.681 174.219 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.8 tp -86.39 157.66 19.8 Favored 'General case' 0 N--CA 1.389 -3.491 0 CA-C-N 113.641 -1.618 . . . . 1.51 109.393 -171.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.445 ' O ' HD11 ' A' ' 75' ' ' LEU . 84.8 mt -106.74 126.36 52.2 Favored 'General case' 0 N--CA 1.407 -2.616 0 N-CA-C 108.901 -0.777 . . . . 0.8 108.901 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 56.3 p -93.42 -173.35 3.19 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 107.074 -1.454 . . . . 0.63 107.074 171.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.937 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.0 m -56.96 -47.14 81.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 109.087 -0.709 . . . . 0.61 109.087 175.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -58.74 -47.34 84.94 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.226 -0.897 . . . . 1.65 112.055 177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -66.29 -32.29 73.62 Favored 'General case' 0 CA--C 1.498 -1.043 0 C-N-CA 120.652 -0.419 . . . . 1.41 110.489 -177.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.411 HD11 ' CD1' ' A' ' 74' ' ' LEU . 17.8 tp -68.09 -46.73 70.18 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 108.807 -0.812 . . . . 0.48 108.807 178.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.579 ' O ' HG23 ' A' ' 15' ' ' VAL . 47.3 ttp180 -51.57 -48.39 63.14 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.791 -0.64 . . . . 2.46 110.574 176.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.491 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.7 ttm105 -53.39 -43.4 67.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 115.479 -0.782 . . . . 3.93 111.54 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.404 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -62.78 -40.76 98.32 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.032 0.444 . . . . 0.5 110.614 -179.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.46 HD12 HG21 ' A' ' 48' ' ' THR . 10.2 mp -65.95 -37.43 86.01 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.939 -0.573 . . . . 1.44 110.893 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.579 HG23 ' O ' ' A' ' 11' ' ' ARG . 16.5 t -71.47 -36.6 61.24 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 121.462 0.648 . . . . 0.8 109.398 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 60.3 mm-40 -64.04 -34.17 77.4 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 121.65 -0.657 . . . . 2.05 111.065 176.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.1 t -84.02 -52.43 6.32 Favored 'General case' 0 CA--C 1.559 1.312 0 CA-C-N 116.309 -0.405 . . . . 1.39 111.498 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -106.5 0.72 24.89 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 113.087 0.773 . . . . 1.58 113.087 -173.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.47 -147.62 42.5 Favored Glycine 0 N--CA 1.437 -1.296 0 N-CA-C 110.407 -1.077 . . . . 2.32 110.407 -177.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.92 13.63 33.22 Favored 'General case' 0 C--N 1.295 -1.767 0 CA-C-O 121.463 0.649 . . . . 5.17 109.496 175.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.5 m -70.8 -71.13 0.26 Allowed 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 106.977 -1.49 . . . . 4.86 106.977 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -86.52 108.0 18.35 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 107.194 -1.41 . . . . 4.5 107.194 172.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 168.62 60.89 0.03 OUTLIER Glycine 0 CA--C 1.462 -3.268 0 N-CA-C 109.158 -1.577 . . . . 2.77 109.158 -177.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.3 m -93.81 83.13 4.35 Favored 'General case' 0 N--CA 1.394 -3.235 0 CA-C-N 113.921 -1.139 . . . . 2.87 110.48 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 74.42 60.11 0.08 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.761 1.224 . . . . 3.23 111.935 178.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.416 ' HG ' ' CD2' ' A' ' 30' ' ' PHE . 9.6 mp -100.09 -5.11 28.43 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.958 -1.019 . . . . 1.16 110.657 178.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m -71.21 139.19 50.04 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-N 115.531 -0.758 . . . . 1.46 109.749 179.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.48 -117.43 4.84 Favored Glycine 0 CA--C 1.499 -0.934 0 N-CA-C 109.923 -1.271 . . . . 1.02 109.923 -176.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.937 ' HA ' HG21 ' A' ' 7' ' ' THR . 17.4 m-20 -126.33 113.14 16.53 Favored 'General case' 0 CA--C 1.487 -1.452 0 CA-C-N 117.403 0.601 . . . . 2.07 109.821 177.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.416 ' CD2' ' HG ' ' A' ' 26' ' ' LEU . 18.1 p90 -112.88 9.91 18.96 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.547 -0.751 . . . . 0.44 109.98 179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.818 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 59.0 mt -52.93 -24.85 10.15 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.86 1.43 . . . . 0.39 114.86 -177.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -93.25 -19.94 20.91 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-O 120.819 0.342 . . . . 2.04 110.547 -176.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 30' ' ' PHE . 7.5 mp -77.89 125.0 28.69 Favored 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 109.347 -0.612 . . . . 1.37 109.347 -176.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -74.85 135.61 41.58 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.743 -0.836 . . . . 3.94 108.743 -177.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -56.85 -46.65 81.6 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.354 0.409 . . . . 0.35 109.914 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -55.08 -28.54 53.18 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.156 0.982 . . . . 2.79 111.247 178.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -85.59 -32.83 21.88 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.812 -0.631 . . . . 0.88 111.873 -178.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.3 pt -96.26 30.4 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 113.836 1.051 . . . . 0.6 113.836 -176.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.96 -16.78 60.6 Favored Glycine 0 C--N 1.316 -0.531 0 C-N-CA 120.587 -0.816 . . . . 0.66 113.521 174.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.439 ' CZ ' HD23 ' A' ' 14' ' ' LEU . 35.5 m-85 -81.61 163.93 22.22 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.718 0.771 . . . . 1.33 111.578 -177.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -135.46 140.84 45.17 Favored 'General case' 0 C--N 1.285 -2.229 0 N-CA-C 106.088 -1.819 . . . . 1.06 106.088 173.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.486 ' O ' ' HG3' ' A' ' 46' ' ' MET . 57.6 p -48.45 -32.57 7.96 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 124.562 1.145 . . . . 1.03 113.641 178.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.426 ' HA ' ' HE2' ' A' ' 46' ' ' MET . 6.1 tt -64.98 -50.63 65.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 109.482 -0.562 . . . . 1.56 109.482 177.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.49 -36.15 81.61 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-O 121.41 0.624 . . . . 0.43 110.293 178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.545 HD21 HG23 ' A' ' 68' ' ' VAL . 61.0 tp -61.25 -37.15 82.05 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.83 -1.077 . . . . 0.43 110.54 179.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.486 ' HG3' ' O ' ' A' ' 42' ' ' SER . 70.0 mtm -63.1 -33.1 74.72 Favored 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 111.884 0.327 . . . . 1.49 111.884 178.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.66 -37.42 87.52 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.09 0.948 . . . . 1.88 109.468 177.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.46 HG21 HD12 ' A' ' 14' ' ' LEU . 31.2 m -66.94 -54.6 20.41 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.295 -1.321 . . . . 0.45 108.073 -179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.496 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.63 -34.81 69.71 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-N 114.916 -1.038 . . . . 0.27 110.044 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.94 -41.9 88.48 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 123.237 0.615 . . . . 0.33 111.322 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.6 mtp180 -64.93 -40.71 95.46 Favored 'General case' 0 C--O 1.211 -0.95 0 CA-C-N 115.34 -0.845 . . . . 2.84 110.024 177.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.404 HD21 ' HB2' ' A' ' 13' ' ' ALA . 97.3 mt -63.96 -41.14 97.65 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.974 -0.557 . . . . 0.9 110.922 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.5 mt-10 -56.58 -55.0 39.45 Favored 'General case' 0 CA--C 1.519 -0.243 0 O-C-N 123.686 0.616 . . . . 0.48 109.58 174.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.9 t -63.87 -42.44 97.51 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.097 -0.956 . . . . 1.19 111.757 -177.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.7 tmt_? -65.15 -51.91 58.35 Favored 'General case' 0 C--O 1.215 -0.725 0 C-N-CA 123.034 0.534 . . . . 3.07 111.636 -177.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.618 ' HE1' ' HB ' ' A' ' 3' ' ' THR . 92.3 m-85 -93.68 -7.74 42.9 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 113.52 0.933 . . . . 1.01 113.52 -171.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.92 53.95 4.71 Favored Glycine 0 C--N 1.312 -0.793 0 C-N-CA 120.458 -0.877 . . . . 0.93 111.357 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.451 HG22 ' H ' ' A' ' 59' ' ' SER . 9.9 p -139.5 176.33 6.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.537 0 N-CA-C 108.001 -1.111 . . . . 1.16 108.001 -177.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.451 ' H ' HG22 ' A' ' 58' ' ' VAL . 12.1 p -141.81 140.92 33.11 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 118.624 0.647 . . . . 1.87 110.422 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.496 HD12 ' HB1' ' A' ' 49' ' ' ALA . 61.2 mt -126.25 123.32 24.25 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.096 -1.076 . . . . 0.57 108.096 -179.264 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.57 128.07 25.87 Favored 'Trans proline' 0 C--O 1.24 0.58 0 C-N-CA 122.361 2.041 . . . . 0.87 110.1 177.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -53.66 -27.86 29.9 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.962 0.905 . . . . 1.83 113.355 -177.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -67.2 -44.71 78.94 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.495 -0.557 . . . . 2.34 109.495 177.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 49.1 t -72.89 -41.94 60.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 108.852 -0.796 . . . . 0.66 108.852 -178.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.98 -27.82 63.81 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 115.68 -0.691 . . . . 0.51 111.854 178.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.35 -1.51 47.49 Favored Glycine 0 N--CA 1.44 -1.087 0 C-N-CA 120.437 -0.887 . . . . 0.61 112.052 177.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.7 tpm_? -99.57 -10.55 21.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.295 0.569 . . . . 3.98 110.549 -177.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.545 HG23 HD21 ' A' ' 45' ' ' LEU . 13.2 m -79.32 103.82 6.69 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.805 0 CA-C-O 121.582 0.706 . . . . 0.44 110.041 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.93 -40.36 14.88 Favored 'General case' 0 CA--C 1.482 -1.67 0 CA-C-N 115.523 -0.762 . . . . 1.91 110.862 -177.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.1 p -107.86 133.03 20.62 Favored Pre-proline 0 N--CA 1.402 -2.865 0 CA-C-N 115.261 -0.881 . . . . 0.47 110.153 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.818 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.7 Cg_exo -50.71 -31.75 33.71 Favored 'Trans proline' 0 C--O 1.213 -0.755 0 C-N-CA 123.867 3.045 . . . . 0.32 113.285 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 73' ' ' GLU . 11.5 ptp85 -52.94 -48.1 67.57 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-O 120.923 0.392 . . . . 1.48 110.781 178.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.412 ' N ' ' HG3' ' A' ' 72' ' ' ARG . 10.5 mm-40 -66.15 -41.45 90.38 Favored 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 123.88 0.872 . . . . 2.13 110.651 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.544 HD23 HG21 ' A' ' 68' ' ' VAL . 3.0 tm? -68.26 -45.55 72.85 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.092 -0.958 . . . . 0.9 109.454 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 5' ' ' LEU . 32.3 tp -57.16 -51.9 67.45 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.724 -0.671 . . . . 0.34 109.392 178.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -56.65 -45.0 81.86 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.044 0.938 . . . . 0.57 112.1 179.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -61.39 -49.33 77.32 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.296 -0.631 . . . . 1.96 109.296 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.455 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 61.6 mt -66.88 -45.21 88.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 116.168 -0.469 . . . . 0.55 110.396 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -54.04 -45.95 71.77 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.563 0.345 . . . . 1.14 110.671 177.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.6 -42.56 97.31 Favored Glycine 0 N--CA 1.442 -0.95 0 CA-C-N 115.887 -0.597 . . . . 0.53 112.377 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.62 -38.28 80.42 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 122.323 0.249 . . . . 0.6 110.818 -179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 80.3 mt -60.79 -46.18 91.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.385 0.612 . . . . 1.42 110.28 177.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.72 -19.38 65.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.672 -0.695 . . . . 0.85 111.548 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -98.59 7.21 46.4 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-O 121.848 0.832 . . . . 2.44 110.756 -177.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -94.56 18.49 11.32 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 121.732 -0.605 . . . . 2.12 110.463 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 C-N-CA 125.119 1.368 . . . . 3.84 110.01 -177.083 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 CA--C 1.506 -0.719 0 N-CA-C 108.673 -0.862 . . . . 6.63 108.673 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.604 ' HB1' ' HG ' ' A' ' 82' ' ' LEU . . . -140.19 104.56 4.84 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 121.209 0.528 . . . . 4.09 111.287 -178.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 80.7 m -93.55 118.7 31.69 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 107.998 -1.112 . . . . 2.77 107.998 174.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.5 tp -56.63 149.36 17.82 Favored 'General case' 0 N--CA 1.421 -1.885 0 CA-C-N 113.857 -1.519 . . . . 1.51 112.075 -172.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.08 127.07 35.99 Favored 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 114.865 -1.061 . . . . 0.8 109.827 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -101.2 179.82 4.26 Favored 'General case' 0 C--N 1.284 -2.247 0 N-CA-C 107.07 -1.455 . . . . 0.63 107.07 170.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.885 HG21 ' HA ' ' A' ' 29' ' ' ASP . 19.4 m -58.29 -40.88 83.14 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 121.413 0.625 . . . . 0.61 109.594 176.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -57.39 -53.7 55.2 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 114.747 -1.115 . . . . 1.65 111.237 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 12' ' ' ARG . 8.5 t70 -69.6 -33.23 72.39 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-O 121.293 0.568 . . . . 1.41 110.395 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.493 HD11 HD12 ' A' ' 74' ' ' LEU . 17.8 tp -65.32 -45.89 82.48 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.158 -0.682 . . . . 0.48 109.158 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 15' ' ' VAL . 45.4 ttp180 -54.25 -43.91 71.34 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 123.937 0.895 . . . . 2.46 109.978 176.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.48 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 53.6 ttt180 -54.84 -45.82 74.54 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 115.163 -0.926 . . . . 3.93 110.726 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.478 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -61.05 -40.65 94.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.094 -0.503 . . . . 0.5 111.148 -178.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -64.78 -44.2 90.74 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 121.105 -0.238 . . . . 1.44 111.201 177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 11' ' ' ARG . 60.6 t -63.19 -47.95 89.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.284 -0.416 . . . . 0.8 110.019 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -63.04 -32.17 73.47 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.832 0.308 . . . . 2.05 111.832 179.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.497 ' HA ' ' NE ' ' A' ' 51' ' ' ARG . 35.7 t -74.45 -52.96 10.52 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 120.773 0.321 . . . . 1.39 111.395 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.78 -44.45 61.55 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.308 -0.405 . . . . 1.58 111.614 -176.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.38 -125.55 8.16 Favored Glycine 0 N--CA 1.429 -1.773 0 N-CA-C 109.577 -1.409 . . . . 2.32 109.577 -177.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -84.77 102.77 13.29 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.306 0.574 . . . . 5.17 111.155 177.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.2 t -139.28 -156.19 0.66 Allowed 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 107.042 -1.466 . . . . 4.86 107.042 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -122.3 123.43 41.41 Favored 'General case' 0 C--N 1.293 -1.86 0 N-CA-C 109.391 -0.596 . . . . 4.5 109.391 175.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -85.28 63.89 4.27 Favored Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 110.907 -0.877 . . . . 2.77 110.907 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.462 HG23 HG22 ' A' ' 38' ' ' ILE . 9.2 t -59.89 92.91 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.416 1.086 . . . . 2.87 111.467 -177.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 64.61 24.95 13.08 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-N 114.404 -1.271 . . . . 3.23 110.405 -178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.2 tp -76.75 -33.66 58.1 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.874 -1.057 . . . . 1.16 109.581 -176.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.0 m -61.05 133.91 56.54 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.063 -0.971 . . . . 1.46 110.436 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.36 -136.86 14.01 Favored Glycine 0 N--CA 1.433 -1.528 0 N-CA-C 110.457 -1.057 . . . . 1.02 110.457 -176.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.885 ' HA ' HG21 ' A' ' 7' ' ' THR . 4.2 m-20 -100.1 98.84 9.51 Favored 'General case' 0 CA--C 1.49 -1.359 0 CA-C-O 121.319 0.581 . . . . 2.07 110.638 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.447 ' HA ' HD23 ' A' ' 33' ' ' LEU . 21.7 p90 -95.35 13.26 26.31 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.391 -0.822 . . . . 0.44 110.144 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.725 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 58.6 mt -50.82 -23.95 3.14 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.82 1.785 . . . . 0.39 115.82 -175.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -95.98 -8.93 32.39 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-O 121.39 0.614 . . . . 2.04 111.414 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 30' ' ' PHE . 3.9 mm? -79.12 123.72 27.63 Favored 'General case' 0 CA--C 1.5 -0.969 0 N-CA-C 109.612 -0.514 . . . . 1.37 109.612 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 63.2 mtp180 -75.48 141.52 43.07 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 108.175 -1.046 . . . . 3.94 108.175 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.423 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 62.6 m-85 -59.99 -41.38 91.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 110.278 -0.268 . . . . 0.35 110.278 -178.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -57.76 -27.37 62.99 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.355 0.597 . . . . 2.79 111.344 176.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -84.79 -33.96 22.88 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.094 0.473 . . . . 0.88 110.895 -177.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.462 HG22 HG23 ' A' ' 24' ' ' THR . 27.2 pt -93.15 16.91 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 112.634 0.605 . . . . 0.6 112.634 -178.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.79 43.18 18.84 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 116.059 -0.519 . . . . 0.66 113.411 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.423 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 15.2 m-85 -126.93 117.09 21.84 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 122.684 -0.304 . . . . 1.33 111.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.43 151.85 24.39 Favored 'General case' 0 CA--C 1.474 -1.956 0 N-CA-C 108.269 -1.011 . . . . 1.06 108.269 171.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.466 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 15.7 p -53.45 -30.35 40.15 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 113.616 0.969 . . . . 1.03 113.616 176.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.2 tt -62.76 -54.59 36.84 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 108.625 -0.88 . . . . 1.56 108.625 176.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.06 80.16 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 123.053 0.541 . . . . 0.43 111.064 177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.516 ' O ' ' HB ' ' A' ' 48' ' ' THR . 65.0 tp -64.3 -41.07 97.04 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.907 -0.588 . . . . 0.43 110.912 177.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 71.4 mtm -64.28 -31.73 73.05 Favored 'General case' 0 C--O 1.196 -1.723 0 O-C-N 122.026 -0.422 . . . . 1.49 111.541 176.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.562 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 9.3 tp10 -63.58 -33.03 74.7 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.731 0.777 . . . . 1.88 109.237 174.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 39.7 m -66.4 -55.32 16.36 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.398 -1.334 . . . . 0.45 107.398 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.06 -39.69 75.41 Favored 'General case' 0 C--O 1.207 -1.175 0 CA-C-N 114.345 -1.298 . . . . 0.27 109.888 175.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.25 -45.98 86.79 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 123.775 0.83 . . . . 0.33 111.95 179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 56.4 mtt180 -65.03 -37.15 86.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.707 -0.679 . . . . 2.84 109.908 178.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 13' ' ' ALA . 81.3 mt -65.59 -38.94 90.93 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 116.049 -0.523 . . . . 0.9 111.039 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.6 mt-10 -56.6 -55.08 38.5 Favored 'General case' 0 CA--C 1.502 -0.888 0 O-C-N 123.626 0.579 . . . . 0.48 109.482 175.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 25.2 m -62.07 -40.61 96.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.518 -0.764 . . . . 1.19 112.136 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -66.09 -49.46 67.52 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.124 -0.489 . . . . 3.07 112.14 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -98.51 -11.16 22.54 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.947 1.462 . . . . 1.01 114.947 -174.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.74 53.08 6.66 Favored Glycine 0 C--N 1.313 -0.738 0 C-N-CA 120.415 -0.898 . . . . 0.93 111.188 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.6 p -135.24 137.49 50.07 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.265 0 N-CA-C 108.448 -0.945 . . . . 1.16 108.448 -177.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 18.4 m -96.57 114.54 26.21 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-O 120.722 0.296 . . . . 1.87 110.7 -179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.2 mt -104.62 122.24 44.28 Favored Pre-proline 0 C--N 1.32 -0.695 0 C-N-CA 122.931 0.492 . . . . 0.57 109.969 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -67.78 131.73 24.95 Favored 'Trans proline' 0 CA--C 1.543 0.948 0 C-N-CA 122.956 2.437 . . . . 0.87 112.07 178.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -52.06 -40.51 61.26 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.848 1.259 . . . . 1.83 113.742 -176.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.44 -37.85 83.63 Favored 'General case' 0 CA--C 1.496 -1.098 0 C-N-CA 120.901 -0.32 . . . . 2.34 110.533 -177.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 34.0 t -75.23 -42.01 44.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.075 0 N-CA-C 108.891 -0.781 . . . . 0.66 108.891 -178.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.88 -32.05 69.14 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 115.603 -0.726 . . . . 0.51 111.386 177.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -97.87 9.68 63.97 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.73 -0.748 . . . . 0.61 112.273 177.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.5 tpt180 -100.41 -24.13 14.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 120.952 0.406 . . . . 3.98 110.292 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.536 HG21 HD23 ' A' ' 74' ' ' LEU . 20.8 m -75.68 103.88 3.55 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.179 0 CA-C-O 122.029 0.918 . . . . 0.44 111.032 -177.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -87.74 -30.32 20.4 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-N 115.132 -0.94 . . . . 1.91 111.488 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.4 p -122.51 145.53 45.04 Favored Pre-proline 0 N--CA 1.419 -1.981 0 CA-C-N 115.946 -0.57 . . . . 0.47 109.836 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.725 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 66.4 Cg_exo -53.07 -40.73 75.77 Favored 'Trans proline' 0 CA--C 1.509 -0.773 0 C-N-CA 124.023 3.148 . . . . 0.32 114.024 -175.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 9.9 ptp85 -52.36 -39.78 61.17 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 123.495 0.497 . . . . 1.48 111.663 179.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 43.9 mm-40 -64.22 -51.55 63.15 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 115.933 -0.576 . . . . 2.13 109.837 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.536 HD23 HG21 ' A' ' 68' ' ' VAL . 3.4 tm? -67.34 -39.76 85.83 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.619 -1.173 . . . . 0.9 110.213 -176.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.433 HD13 HD22 ' A' ' 10' ' ' LEU . 48.0 tp -56.91 -57.67 11.5 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 109.219 -0.659 . . . . 0.34 109.219 177.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -57.87 -37.86 74.7 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 123.766 0.666 . . . . 0.57 111.438 -179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.3 tp -59.57 -53.08 62.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.682 -0.69 . . . . 1.96 110.439 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.465 HG22 HD13 ' A' ' 82' ' ' LEU . 44.9 mt -76.08 -21.92 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 C-N-CA 120.364 -0.534 . . . . 0.55 110.53 -178.263 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -64.83 -50.29 67.28 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.853 -0.795 . . . . 1.14 108.853 173.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -64.66 -38.24 95.41 Favored Glycine 0 N--CA 1.439 -1.125 0 CA-C-N 115.249 -0.887 . . . . 0.53 111.668 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.75 -39.11 84.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.433 0.159 . . . . 0.6 110.845 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.604 ' HG ' ' HB1' ' A' ' 2' ' ' ALA . 5.3 mp -70.86 -39.01 73.15 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 122.357 0.263 . . . . 1.42 111.4 178.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.7 -34.14 77.22 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.567 0.698 . . . . 0.85 110.019 175.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -78.39 -20.14 51.84 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.458 -0.792 . . . . 2.44 110.145 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.82 -15.3 58.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 112.246 0.461 . . . . 2.12 112.246 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.306 -1.319 0 N-CA-C 109.356 -0.609 . . . . 3.84 109.356 178.656 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.1 mmm . . . . . 0 CA--C 1.511 -0.545 0 N-CA-C 108.885 -0.783 . . . . 6.63 108.885 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.33 -67.21 0.6 Allowed 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.237 -0.653 . . . . 4.09 109.237 177.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' A' ' 4' ' ' LEU . 31.3 p -128.07 102.51 6.76 Favored 'General case' 0 CA--C 1.486 -1.494 0 C-N-CA 119.779 -0.769 . . . . 2.77 109.353 175.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.522 ' HA ' ' HG ' ' A' ' 82' ' ' LEU . 22.6 tp 151.42 156.7 0.0 OUTLIER 'General case' 0 N--CA 1.418 -2.034 0 N-CA-C 103.616 -2.735 . . . . 1.51 103.616 177.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.546 HD11 HD22 ' A' ' 52' ' ' LEU . 94.9 mt -117.35 124.22 48.39 Favored 'General case' 0 C--N 1.272 -2.772 0 N-CA-C 108.157 -1.053 . . . . 0.8 108.157 173.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 44.9 p -97.6 -171.38 2.17 Favored 'General case' 0 N--CA 1.416 -2.126 0 N-CA-C 107.836 -1.172 . . . . 0.63 107.836 170.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.1 m -52.25 -54.98 24.33 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 123.891 0.876 . . . . 0.61 111.436 -177.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.444 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . 32.1 t70 -72.07 -28.13 63.13 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 112.713 0.634 . . . . 1.65 112.713 -178.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -65.47 -44.98 85.45 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.573 -0.899 . . . . 1.41 108.573 178.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 30.9 tp -65.68 -47.39 75.63 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 114.626 -1.17 . . . . 0.48 108.881 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' HB3' ' HA ' ' A' ' 8' ' ' ASP . 36.7 ttt-85 -49.54 -51.51 36.13 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.343 1.057 . . . . 2.46 110.963 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 65.6 ttt180 -59.08 -50.58 73.54 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.435 -0.348 . . . . 3.93 111.581 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.26 -36.22 77.29 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 116.13 -0.486 . . . . 0.5 111.323 -176.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.624 HD23 HG21 ' A' ' 48' ' ' THR . 99.1 mt -63.34 -53.52 51.37 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.523 0.514 . . . . 1.44 110.169 177.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.535 ' HA ' HG21 ' A' ' 21' ' ' THR . 94.6 t -57.97 -45.92 87.84 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-N 115.949 -0.569 . . . . 0.8 111.355 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.624 ' HB2' HH12 ' A' ' 51' ' ' ARG . 55.6 mt-10 -60.87 -30.46 70.15 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 116.503 -0.317 . . . . 2.05 111.723 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 m -89.77 -33.61 16.49 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 121.128 -0.229 . . . . 1.39 111.428 -176.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.51 -29.85 52.66 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 120.813 0.339 . . . . 1.58 111.258 -179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.57 -82.77 1.65 Allowed Glycine 0 C--O 1.245 0.819 0 N-CA-C 110.846 -0.901 . . . . 2.32 110.846 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -98.08 111.9 24.05 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.468 -0.938 . . . . 5.17 108.468 177.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.535 HG21 ' HA ' ' A' ' 15' ' ' VAL . 4.2 t -156.19 109.3 2.66 Favored 'General case' 0 N--CA 1.414 -2.228 0 CA-C-O 122.587 1.184 . . . . 4.86 111.063 -177.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -98.62 -59.58 1.71 Allowed 'General case' 0 C--N 1.282 -2.358 0 CA-C-N 113.858 -1.519 . . . . 4.5 107.719 174.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.71 -73.99 0.95 Allowed Glycine 0 N--CA 1.434 -1.499 0 CA-C-N 115.149 -0.932 . . . . 2.77 112.582 179.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.8 t 176.74 -149.78 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 104.552 -2.388 . . . . 2.87 104.552 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -81.72 109.42 16.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 107.645 -1.243 . . . . 3.23 107.645 172.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.0 tp -96.54 -3.03 43.87 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.734 -1.121 . . . . 1.16 109.131 -174.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 p -81.0 140.18 35.34 Favored 'General case' 0 N--CA 1.416 -2.173 0 CA-C-N 114.331 -1.304 . . . . 1.46 110.953 178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.19 -143.19 16.39 Favored Glycine 0 C--N 1.308 -0.988 0 N-CA-C 110.902 -0.879 . . . . 1.02 110.902 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -89.26 98.47 11.78 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 109.264 -0.643 . . . . 2.07 109.264 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.9 p90 -100.36 3.66 43.43 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 108.921 -0.77 . . . . 0.44 108.921 176.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.692 HD13 ' HB3' ' A' ' 72' ' ' ARG . 41.4 mt -54.2 -26.68 29.59 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.541 1.136 . . . . 0.39 113.99 -176.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -90.32 -19.31 24.2 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.733 0.778 . . . . 2.04 110.445 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -81.96 123.71 29.12 Favored 'General case' 0 C--N 1.296 -1.755 0 N-CA-C 108.317 -0.994 . . . . 1.37 108.317 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -74.63 146.0 42.79 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 116.278 -0.419 . . . . 3.94 110.292 -176.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.543 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 70.2 m-85 -61.94 -32.91 73.37 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.342 0.591 . . . . 0.35 109.543 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -54.72 -40.68 69.48 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 114.739 -1.119 . . . . 2.79 110.182 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -81.1 -33.34 33.39 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 114.941 -1.027 . . . . 0.88 111.06 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.5 pt -92.14 19.55 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 N-CA-C 112.26 0.467 . . . . 0.6 112.26 -177.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 69.34 46.33 57.15 Favored Glycine 0 CA--C 1.511 -0.177 0 CA-C-N 116.122 -0.49 . . . . 0.66 113.626 174.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.543 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 7.7 m-85 -118.86 124.89 48.25 Favored 'General case' 0 C--N 1.3 -1.578 0 CA-C-O 120.724 0.297 . . . . 1.33 111.502 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -84.7 134.1 34.36 Favored 'General case' 0 CA--C 1.484 -1.572 0 N-CA-C 107.709 -1.219 . . . . 1.06 107.709 172.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.505 ' O ' ' HB3' ' A' ' 45' ' ' LEU . 15.9 m -53.63 -26.12 20.72 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 123.607 0.567 . . . . 1.03 111.418 174.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 64.7 tp -64.7 -49.89 69.13 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.78 -0.575 . . . . 1.56 110.099 174.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.86 73.28 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 122.128 0.966 . . . . 0.43 109.702 177.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.624 HD21 HG23 ' A' ' 68' ' ' VAL . 33.8 tp -62.77 -50.64 70.23 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 114.49 -1.232 . . . . 0.43 108.957 176.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.466 ' HG3' ' O ' ' A' ' 42' ' ' SER . 89.9 mtp -62.56 -33.29 74.66 Favored 'General case' 0 C--O 1.206 -1.233 0 CA-C-N 116.264 -0.425 . . . . 1.49 110.823 176.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -61.71 -36.59 81.35 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 122.159 0.981 . . . . 1.88 108.757 177.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.624 HG21 HD23 ' A' ' 14' ' ' LEU . 89.3 m -68.57 -57.65 5.44 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.245 -1.391 . . . . 0.45 107.245 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.619 ' HA ' HD12 ' A' ' 52' ' ' LEU . . . -54.82 -33.02 61.08 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 113.908 -1.496 . . . . 0.27 111.07 178.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.65 -46.92 83.57 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.154 0.502 . . . . 0.33 111.567 178.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.624 HH12 ' HB2' ' A' ' 16' ' ' GLU . 66.7 mtp180 -64.07 -37.79 88.7 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.307 -0.861 . . . . 2.84 109.634 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.619 HD12 ' HA ' ' A' ' 49' ' ' ALA . 65.1 mt -66.14 -47.97 72.31 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.9 110.295 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.9 mt-10 -58.43 -40.58 82.94 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.903 0.383 . . . . 0.48 110.246 175.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 36.8 t -61.26 -64.39 0.97 Allowed 'General case' 0 CA--C 1.554 1.097 0 CA-C-N 115.203 -0.908 . . . . 1.19 111.005 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 28.9 ttm180 -63.86 -41.67 97.72 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.354 0.872 . . . . 3.07 113.354 -175.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.443 ' HE1' ' HA ' ' A' ' 3' ' ' THR . 92.4 m-85 -93.2 -4.5 51.9 Favored 'General case' 0 C--N 1.308 -1.234 0 N-CA-C 112.999 0.741 . . . . 1.01 112.999 -171.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 65.86 26.06 72.07 Favored Glycine 0 C--O 1.239 0.456 0 C-N-CA 120.981 -0.628 . . . . 0.93 112.562 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.791 HG12 ' HB3' ' A' ' 85' ' ' ALA . 28.9 m -99.15 173.96 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-N 115.937 -0.132 . . . . 1.16 110.749 -179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.2 p -141.9 113.68 7.91 Favored 'General case' 0 C--N 1.297 -1.686 0 CA-C-O 121.421 0.629 . . . . 1.87 112.05 -176.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.488 HD12 ' HB1' ' A' ' 49' ' ' ALA . 63.4 mt -103.92 127.29 29.65 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 108.509 -0.923 . . . . 0.57 108.509 -179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.72 136.66 68.04 Favored 'Trans proline' 0 C--O 1.242 0.681 0 C-N-CA 122.37 2.047 . . . . 0.87 110.645 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -52.72 -41.87 64.35 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 112.902 0.704 . . . . 1.83 112.902 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -68.28 -32.51 72.72 Favored 'General case' 0 C--O 1.183 -2.429 0 CA-C-N 116.481 -0.327 . . . . 2.34 110.447 -177.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 79.2 t -74.6 -44.74 46.6 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 N-CA-C 109.093 -0.706 . . . . 0.66 109.093 179.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.04 -35.37 66.81 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.531 0.732 . . . . 0.51 112.516 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -107.54 23.08 27.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.538 -0.839 . . . . 0.61 112.967 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 ttt180 -134.87 -0.28 2.84 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.8 0.81 . . . . 3.98 110.451 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.624 HG23 HD21 ' A' ' 45' ' ' LEU . 6.3 m -78.5 101.9 4.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.268 -1.012 . . . . 0.44 108.268 173.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -89.96 -30.52 17.75 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-N 114.49 -1.232 . . . . 1.91 110.295 -173.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.451 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 42.4 p -114.85 130.61 24.01 Favored Pre-proline 0 N--CA 1.403 -2.788 0 CA-C-N 115.085 -0.962 . . . . 0.47 109.914 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.645 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 86.4 Cg_exo -47.91 -46.74 20.85 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.095 3.197 . . . . 0.32 113.738 -175.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.692 ' HB3' HD13 ' A' ' 31' ' ' LEU . 18.2 ptt180 -54.33 -37.28 64.69 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 114.155 1.169 . . . . 1.48 114.155 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -66.54 -43.56 84.8 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 121.159 0.504 . . . . 2.13 110.976 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.486 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 3.2 tm? -69.22 -45.07 70.73 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 115.203 -0.908 . . . . 0.9 109.398 179.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 35.6 tp -56.31 -49.79 73.3 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 123.454 0.702 . . . . 0.34 109.411 178.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -57.23 -46.11 83.26 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.166 -0.925 . . . . 0.57 111.503 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -61.05 -47.12 87.83 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.241 -0.651 . . . . 1.96 109.241 -178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.492 HG21 HD12 ' A' ' 5' ' ' LEU . 58.3 mt -70.3 -27.98 33.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 120.795 0.331 . . . . 0.55 111.563 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -39.23 83.91 Favored 'General case' 0 C--N 1.321 -0.656 0 O-C-N 121.922 -0.486 . . . . 1.14 110.032 174.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.51 -39.58 91.09 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.772 -0.931 . . . . 0.53 110.772 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -66.44 -42.28 87.87 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.677 0.275 . . . . 0.6 110.503 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.777 HD22 HG11 ' A' ' 58' ' ' VAL . 4.0 mm? -69.74 -27.57 65.06 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 111.878 0.325 . . . . 1.42 111.878 176.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.51 -33.26 75.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.471 0.653 . . . . 0.85 109.483 174.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -88.74 -57.35 2.94 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.26 -0.882 . . . . 2.44 112.958 -177.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.791 ' HB3' HG12 ' A' ' 58' ' ' VAL . . . -91.86 18.63 7.5 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 114.286 1.217 . . . . 2.12 114.286 -170.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -0.985 0 N-CA-C 108.668 -0.864 . . . . 3.84 108.668 174.453 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 mmt . . . . . 0 C--O 1.242 0.666 0 N-CA-C 112.017 0.377 . . . . 6.63 112.017 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -89.79 110.73 21.63 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 108.361 -0.977 . . . . 4.09 108.361 177.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 30.7 p -79.92 121.86 25.97 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.024 0.44 . . . . 2.77 110.252 -178.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB3' ' OD1' ' A' ' 79' ' ' ASN . 9.1 mp -64.22 160.4 18.64 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.819 0.819 . . . . 1.51 112.218 -179.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.463 HD11 ' CD1' ' A' ' 52' ' ' LEU . 38.6 mt -96.05 142.69 27.95 Favored 'General case' 0 C--N 1.286 -2.179 0 CA-C-N 115.16 -0.927 . . . . 0.8 112.329 -167.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.8 p -101.99 -178.15 3.62 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.451 -1.685 . . . . 0.63 106.451 168.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.866 HG21 ' HA ' ' A' ' 29' ' ' ASP . 11.4 m -59.88 -32.92 71.17 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.315 0.578 . . . . 0.61 110.081 175.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.588 ' O ' ' HG3' ' A' ' 12' ' ' ARG . 15.7 t70 -67.82 -42.76 81.0 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.627 -0.715 . . . . 1.65 110.043 -178.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.419 ' HB3' HD22 ' A' ' 5' ' ' LEU . 6.9 m-20 -63.92 -38.29 90.53 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.55 -0.75 . . . . 1.41 109.476 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 44.4 tp -66.32 -45.68 79.46 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.182 -0.917 . . . . 0.48 109.844 179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttp180 -52.41 -46.27 66.25 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 122.762 0.425 . . . . 2.46 111.024 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 8' ' ' ASP . 94.4 mtt180 -54.66 -50.1 69.0 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.531 -0.759 . . . . 3.93 110.187 -179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.15 87.32 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.402 -0.817 . . . . 0.5 111.841 -175.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 11.0 mp -66.02 -45.74 80.41 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 121.159 -0.216 . . . . 1.44 110.667 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 82.3 t -57.09 -40.33 72.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.811 0 CA-C-O 121.151 0.5 . . . . 0.8 110.052 177.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 70.1 mm-40 -60.53 -40.08 90.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.741 -0.663 . . . . 2.05 111.408 177.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.9 m -81.29 -34.85 31.72 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 115.492 -0.776 . . . . 1.39 112.162 -174.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.3 -42.93 34.98 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 120.74 0.305 . . . . 1.58 111.558 -178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.55 145.26 13.92 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 109.414 -1.474 . . . . 2.32 109.414 -176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 70.59 147.09 0.07 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.191 0.996 . . . . 5.17 110.265 -176.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.9 t -88.48 -176.18 5.22 Favored 'General case' 0 N--CA 1.414 -2.255 0 N-CA-C 109.168 -0.679 . . . . 4.86 109.168 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 36.2 t70 50.59 79.0 0.09 Allowed 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 124.359 1.063 . . . . 4.5 111.199 -174.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.81 96.94 0.97 Allowed Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.236 -0.893 . . . . 2.77 112.183 -177.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.4 p 43.06 -116.55 0.42 Allowed 'General case' 0 C--O 1.244 0.782 0 C-N-CA 125.528 1.531 . . . . 2.87 113.665 175.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -124.45 26.28 7.36 Favored 'General case' 0 C--N 1.281 -2.406 0 N-CA-C 106.414 -1.699 . . . . 3.23 106.414 177.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.3 tp -81.6 9.27 7.9 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.438 -1.256 . . . . 1.16 110.409 -175.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 p -76.55 138.55 40.26 Favored 'General case' 0 N--CA 1.423 -1.784 0 CA-C-N 115.408 -0.814 . . . . 1.46 110.812 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.74 -139.22 14.42 Favored Glycine 0 N--CA 1.429 -1.823 0 N-CA-C 110.407 -1.077 . . . . 1.02 110.407 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.866 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.4 t70 -105.35 105.36 15.36 Favored 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 109.104 -0.702 . . . . 2.07 109.104 178.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.463 ' HA ' HD23 ' A' ' 33' ' ' LEU . 28.2 p90 -105.4 19.4 20.64 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 116.049 -0.523 . . . . 0.44 111.161 -177.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.857 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 57.9 mt -52.19 -22.9 4.75 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 114.95 1.463 . . . . 0.39 114.95 -177.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -94.97 -20.42 19.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.654 0.264 . . . . 2.04 111.513 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 30' ' ' PHE . 3.4 mm? -78.48 114.1 17.09 Favored 'General case' 0 CA--C 1.499 -0.985 0 CA-C-O 121.453 0.644 . . . . 1.37 109.587 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.596 ' HG2' HG22 ' A' ' 70' ' ' THR . 40.1 mtt180 -76.35 144.04 40.39 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.718 -1.128 . . . . 3.94 109.978 -172.028 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.597 ' HA ' HG12 ' A' ' 38' ' ' ILE . 44.1 m-85 -61.78 -41.9 98.3 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.369 -0.378 . . . . 0.35 110.993 -174.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -37.5 70.43 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.725 0.774 . . . . 2.79 110.338 176.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -81.09 -23.59 38.32 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.247 -0.888 . . . . 0.88 110.963 -174.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.597 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.2 pt -98.22 15.55 3.52 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-O 121.408 0.623 . . . . 0.6 111.788 177.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.32 36.9 38.06 Favored Glycine 0 C--O 1.226 -0.377 0 CA-C-N 115.823 -0.626 . . . . 0.66 113.967 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -113.0 127.58 56.27 Favored 'General case' 0 C--N 1.297 -1.699 0 O-C-N 122.305 -0.527 . . . . 1.33 111.356 177.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -86.05 145.37 27.1 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 106.304 -1.739 . . . . 1.06 106.304 172.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.533 ' O ' ' HG3' ' A' ' 46' ' ' MET . 34.1 p -52.55 -31.37 35.5 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 113.275 0.843 . . . . 1.03 113.275 177.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.5 tp -65.69 -43.16 90.09 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.007 0.432 . . . . 1.56 110.108 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.415 ' O ' ' HB3' ' A' ' 47' ' ' GLU . . . -64.32 -36.38 83.94 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 121.375 0.607 . . . . 0.43 109.392 175.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.556 ' O ' ' HB ' ' A' ' 48' ' ' THR . 50.6 tp -66.39 -40.14 89.49 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 115.3 -0.863 . . . . 0.43 111.621 177.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.533 ' HG3' ' O ' ' A' ' 42' ' ' SER . 60.6 mtt -64.5 -30.19 71.23 Favored 'General case' 0 C--O 1.207 -1.141 0 O-C-N 121.714 -0.616 . . . . 1.49 110.444 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' A' ' 44' ' ' ALA . 7.7 tp10 -61.65 -33.59 74.22 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 122.282 1.039 . . . . 1.88 108.742 178.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.556 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 55.8 m -67.92 -61.65 1.77 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 113.583 -1.644 . . . . 0.45 107.362 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -54.05 -34.54 60.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.319 -1.309 . . . . 0.27 111.026 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.15 -49.72 73.17 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 123.651 0.78 . . . . 0.33 111.896 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.431 ' HA ' ' OG ' ' A' ' 54' ' ' SER . 92.8 mtt180 -67.3 -30.48 70.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.821 -0.627 . . . . 2.84 111.375 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 48' ' ' THR . 3.9 mm? -64.53 -46.59 82.23 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 116.47 -0.332 . . . . 0.9 110.198 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.582 ' HA ' HG12 ' A' ' 58' ' ' VAL . 44.4 mt-10 -57.09 -51.38 69.53 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 115.562 -0.745 . . . . 0.48 110.358 177.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.431 ' OG ' ' HA ' ' A' ' 51' ' ' ARG . 6.4 p -63.45 -52.46 61.34 Favored 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 113.501 0.926 . . . . 1.19 113.501 -178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.483 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 30.3 ttm180 -66.46 -49.84 65.32 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.809 0.67 . . . . 3.07 112.809 -177.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.483 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 99.6 m-85 -92.56 -17.36 24.53 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.056 0.762 . . . . 1.01 113.056 -170.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.15 68.14 1.44 Allowed Glycine 0 N--CA 1.44 -1.096 0 C-N-CA 120.243 -0.979 . . . . 0.93 110.945 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 53' ' ' GLU . 10.8 p -141.61 176.1 4.64 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 N-CA-C 108.066 -1.087 . . . . 1.16 108.066 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.501 ' H ' HG22 ' A' ' 58' ' ' VAL . 4.4 p -140.68 107.36 5.35 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-O 121.345 0.593 . . . . 1.87 109.996 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.445 HD12 ' HB1' ' A' ' 49' ' ' ALA . 61.6 mt -105.99 111.81 64.38 Favored Pre-proline 0 C--N 1.31 -1.109 0 CA-C-N 115.227 -0.897 . . . . 0.57 109.197 -176.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -59.58 130.13 34.06 Favored 'Trans proline' 0 C--O 1.25 1.076 0 C-N-CA 122.629 2.22 . . . . 0.87 111.515 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -51.18 -39.46 56.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.306 1.442 . . . . 1.83 111.961 -177.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.42 -39.02 85.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.496 -0.32 . . . . 2.34 111.292 -177.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.22 -39.54 42.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 109.041 -0.726 . . . . 0.66 109.041 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -36.69 73.88 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.904 -0.589 . . . . 0.51 111.096 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -88.65 4.83 85.08 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 121.015 -0.612 . . . . 0.61 112.349 178.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -102.78 -25.21 13.6 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 122.779 -0.248 . . . . 3.98 111.271 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 m -72.71 105.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.835 0.826 . . . . 0.44 109.933 -178.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.441 ' OD2' ' HD3' ' A' ' 34' ' ' ARG . 34.1 t70 -87.44 -24.28 24.21 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 114.722 -1.126 . . . . 1.91 110.807 -176.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.596 HG22 ' HG2' ' A' ' 34' ' ' ARG . 31.9 p -123.96 138.93 31.44 Favored Pre-proline 0 N--CA 1.418 -2.053 0 CA-C-N 115.685 -0.689 . . . . 0.47 110.705 -178.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.857 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 73.2 Cg_exo -54.73 -34.16 83.23 Favored 'Trans proline' 0 CA--C 1.514 -0.509 0 C-N-CA 123.669 2.913 . . . . 0.32 112.812 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.414 ' HG2' ' HB ' ' A' ' 70' ' ' THR . 3.9 ptp180 -51.8 -45.21 63.76 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 123.413 0.446 . . . . 1.48 111.966 175.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.38 -45.32 88.19 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 121.29 0.567 . . . . 2.13 110.483 178.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 5.1 tt -67.05 -46.2 75.08 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.328 -0.851 . . . . 0.9 109.88 -175.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.42 -46.08 83.93 Favored 'General case' 0 C--O 1.247 0.93 0 CA-C-N 116.216 -0.447 . . . . 0.34 109.803 179.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -63.11 -43.34 98.7 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.189 -0.914 . . . . 0.57 110.546 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.0 tp -57.58 -52.28 66.08 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 123.568 0.747 . . . . 1.96 111.301 -177.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 29.7 mt -68.2 -46.62 80.88 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.558 0 C-N-CA 120.234 -0.586 . . . . 0.55 110.62 -178.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.442 ' OD1' ' HB3' ' A' ' 4' ' ' LEU . 17.1 m-80 -55.99 -42.54 76.51 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 120.61 0.243 . . . . 1.14 110.575 177.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -68.12 -46.38 65.69 Favored Glycine 0 C--N 1.321 -0.304 0 CA-C-N 116.303 -0.408 . . . . 0.53 112.624 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -67.24 -35.91 80.54 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.705 0.288 . . . . 0.6 110.565 -178.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.06 -39.45 79.12 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.376 -0.374 . . . . 1.42 111.138 176.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.55 -42.52 98.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.233 -0.44 . . . . 0.85 110.669 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -84.84 13.61 5.69 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.998 0.74 . . . . 2.44 112.998 179.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.07 73.42 6.36 Favored 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 107.975 -1.121 . . . . 2.12 107.975 173.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.427 -1.587 0 CA-C-N 115.37 -0.832 . . . . 3.84 110.089 -176.529 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mtp . . . . . 0 CA--C 1.512 -0.483 0 N-CA-C 109.827 -0.435 . . . . 6.63 109.827 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.79 157.69 37.64 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 109.146 -0.686 . . . . 4.09 109.146 177.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 13.0 p -71.25 106.64 3.89 Favored 'General case' 0 CA--C 1.491 -1.325 0 CA-C-O 122.24 1.019 . . . . 2.77 109.175 179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 79' ' ' ASN . 25.7 tp -70.07 161.66 29.71 Favored 'General case' 0 N--CA 1.398 -3.031 0 CA-C-N 112.892 -1.958 . . . . 1.51 109.805 -174.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 92.7 mt -92.52 128.48 38.39 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-N 115.855 -0.611 . . . . 0.8 111.051 -176.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.6 p -97.8 -176.35 3.44 Favored 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 106.409 -1.7 . . . . 0.63 106.409 168.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.4 m -57.81 -36.19 71.88 Favored 'General case' 0 C--N 1.312 -1.022 0 O-C-N 123.039 0.212 . . . . 0.61 110.626 174.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 11' ' ' ARG . 25.6 t70 -78.53 -32.71 48.09 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.076 0.465 . . . . 1.65 111.069 -177.301 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -66.46 -42.78 87.07 Favored 'General case' 0 CA--C 1.506 -0.719 0 N-CA-C 108.97 -0.752 . . . . 1.41 108.97 176.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.697 HD11 HD22 ' A' ' 74' ' ' LEU . 13.9 tp -66.54 -41.69 88.34 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.729 -1.123 . . . . 0.48 108.667 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 8' ' ' ASP . 72.6 ttt180 -48.32 -58.48 4.53 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 125.203 1.401 . . . . 2.46 111.601 178.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.54 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 62.3 mtp180 -58.18 -36.44 73.06 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 112.498 0.555 . . . . 3.93 112.498 -179.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.44 -45.2 95.3 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 123.377 0.423 . . . . 0.5 109.905 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.4 mp -65.93 -42.36 90.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.344 -0.389 . . . . 1.44 111.799 177.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 11' ' ' ARG . 90.6 t -54.54 -51.71 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-O 121.029 0.442 . . . . 0.8 110.221 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.615 ' HA ' HG22 ' A' ' 21' ' ' THR . 13.7 mm-40 -63.72 -32.61 74.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.505 -0.77 . . . . 2.05 112.522 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.2 p -94.37 -2.86 51.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 112.745 0.646 . . . . 1.39 112.745 -175.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.21 -25.55 66.97 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.982 0.42 . . . . 1.58 110.91 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 137.57 -83.9 0.25 Allowed Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 120.767 -0.73 . . . . 2.32 112.259 177.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -95.11 24.29 5.03 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.189 0.596 . . . . 5.17 109.767 -175.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.615 HG22 ' HA ' ' A' ' 16' ' ' GLU . 59.2 p 52.24 49.49 20.44 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 123.402 1.573 . . . . 4.86 109.132 -172.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -47.63 -57.3 5.65 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 111.086 -2.779 . . . . 4.5 111.617 -174.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.34 61.58 1.46 Allowed Glycine 0 N--CA 1.432 -1.606 0 C-N-CA 120.113 -1.042 . . . . 2.77 111.237 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -64.4 154.04 36.81 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 123.07 0.548 . . . . 2.87 109.877 177.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.84 82.36 2.77 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 122.881 1.324 . . . . 3.23 112.22 -175.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.649 ' HG ' ' CD2' ' A' ' 30' ' ' PHE . 6.0 mp -109.45 30.87 6.22 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 125.894 1.678 . . . . 1.16 108.053 -178.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.0 m -65.73 100.09 0.51 Allowed 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.593 -1.185 . . . . 1.46 113.704 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 86.88 -69.29 3.1 Favored Glycine 0 N--CA 1.445 -0.747 0 CA-C-N 115.74 -0.663 . . . . 1.02 113.631 174.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -137.56 119.21 15.01 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 109.925 -0.398 . . . . 2.07 109.925 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.649 ' CD2' ' HG ' ' A' ' 26' ' ' LEU . 14.0 p90 -136.4 15.16 3.21 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.261 0.553 . . . . 0.44 110.075 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.644 HD23 ' HB2' ' A' ' 71' ' ' PRO . 60.1 mt -53.48 -24.16 12.25 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 115.183 1.549 . . . . 0.39 115.183 -177.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -95.36 -3.34 47.35 Favored 'General case' 0 N--CA 1.483 1.18 0 N-CA-C 112.387 0.514 . . . . 2.04 112.387 -178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.498 ' O ' ' HD3' ' A' ' 71' ' ' PRO . 8.9 mp -80.63 138.81 36.44 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.394 -0.367 . . . . 1.37 110.698 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.11 141.37 35.83 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 109.785 -0.45 . . . . 3.94 109.785 176.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.433 ' HA ' HG12 ' A' ' 38' ' ' ILE . 50.4 m-85 -68.27 -42.91 78.89 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.362 0.601 . . . . 0.35 109.468 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.537 ' CD ' ' H ' ' A' ' 36' ' ' GLU . 1.5 mp0 -54.67 -34.96 63.04 Favored 'General case' 0 C--N 1.313 -1.0 0 C-N-CA 124.655 1.182 . . . . 2.79 109.921 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -79.32 -31.39 43.12 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.564 -1.198 . . . . 0.88 111.124 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.54 HG13 ' CD1' ' A' ' 40' ' ' TYR . 31.0 pt -93.21 15.78 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 120.485 -0.486 . . . . 0.6 111.572 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.19 34.36 17.76 Favored Glycine 0 C--O 1.238 0.382 0 CA-C-N 115.732 -0.667 . . . . 0.66 114.127 173.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.54 ' CD1' HG13 ' A' ' 38' ' ' ILE . 9.1 m-85 -116.45 123.16 46.82 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 122.598 -0.354 . . . . 1.33 111.264 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.09 151.16 24.35 Favored 'General case' 0 CA--C 1.48 -1.726 0 N-CA-C 106.439 -1.689 . . . . 1.06 106.439 171.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 31.3 p -53.51 -34.63 58.81 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 113.076 0.769 . . . . 1.03 113.076 179.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.71 -45.95 77.1 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 109.307 -0.627 . . . . 1.56 109.307 177.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.78 94.9 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 121.474 0.654 . . . . 0.43 109.846 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.606 HD21 HG23 ' A' ' 68' ' ' VAL . 56.7 tp -62.19 -40.16 95.15 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.686 -1.143 . . . . 0.43 110.175 178.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 81.9 mtp -63.99 -33.15 75.09 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.213 -0.449 . . . . 1.49 111.489 176.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -64.91 -29.3 70.23 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.492 0.663 . . . . 1.88 109.995 179.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 45' ' ' LEU . 24.7 m -64.8 -61.86 1.92 Allowed 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.912 -1.514 . . . . 0.45 106.912 178.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.2 -36.06 70.39 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-N 113.776 -1.556 . . . . 0.27 110.655 177.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.5 -45.9 87.81 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.19 0.596 . . . . 0.33 111.96 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -65.53 -37.52 86.97 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.852 -0.613 . . . . 2.84 110.222 177.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 96.7 mt -64.38 -43.08 95.6 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.194 -0.457 . . . . 0.9 110.667 177.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 40.4 mt-10 -57.0 -54.05 51.16 Favored 'General case' 0 CA--C 1.504 -0.793 0 N-CA-C 109.936 -0.394 . . . . 0.48 109.936 175.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.4 m -61.55 -39.7 92.05 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.912 -1.04 . . . . 1.19 111.783 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.505 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 32.1 ttm180 -67.53 -50.55 58.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.27 -0.423 . . . . 3.07 111.733 -179.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.505 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 89.9 m-85 -96.92 -22.91 16.59 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 114.691 1.367 . . . . 1.01 114.691 -171.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.63 21.66 33.58 Favored Glycine 0 C--N 1.306 -1.113 0 C-N-CA 119.937 -1.125 . . . . 0.93 112.461 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.02 137.41 26.55 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.258 0 N-CA-C 108.645 -0.872 . . . . 1.16 108.645 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.0 m -98.34 113.23 25.13 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-O 121.044 0.449 . . . . 1.87 110.866 -179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.6 mt -99.35 125.24 41.94 Favored Pre-proline 0 C--N 1.31 -1.125 0 CA-C-N 116.251 -0.432 . . . . 0.57 110.026 -178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.415 ' HB2' HG23 ' A' ' 64' ' ' VAL . 36.5 Cg_exo -62.77 116.01 3.28 Favored 'Trans proline' 0 C--O 1.243 0.74 0 C-N-CA 122.2 1.933 . . . . 0.87 110.044 175.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -55.24 -24.25 26.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.92 0.888 . . . . 1.83 113.059 -177.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -68.84 -43.94 74.47 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.175 0.512 . . . . 2.34 110.007 176.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 61' ' ' PRO . 32.6 t -74.55 -34.71 36.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 109.142 -0.688 . . . . 0.66 109.142 -177.266 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.7 -24.5 61.52 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.726 -0.67 . . . . 0.51 111.976 178.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -102.95 -0.11 48.36 Favored Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.548 -0.834 . . . . 0.61 112.449 178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -100.62 -12.81 18.9 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.184 0.516 . . . . 3.98 110.606 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.606 HG23 HD21 ' A' ' 45' ' ' LEU . 19.0 m -74.04 115.96 15.84 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.296 0 CA-C-O 121.635 0.731 . . . . 0.44 110.576 -177.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.98 -49.85 6.53 Favored 'General case' 0 CA--C 1.494 -1.185 0 CA-C-N 114.637 -1.165 . . . . 1.91 109.701 -176.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.528 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 26.5 p -118.15 157.31 49.18 Favored Pre-proline 0 N--CA 1.406 -2.671 0 CA-C-N 114.775 -1.102 . . . . 0.47 109.314 -179.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.644 ' HB2' HD23 ' A' ' 31' ' ' LEU . 49.2 Cg_exo -58.49 -27.28 81.59 Favored 'Trans proline' 0 CA--C 1.5 -1.202 0 C-N-CA 123.591 2.861 . . . . 0.32 112.657 -178.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 43.5 ttm180 -52.97 -48.64 67.27 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.602 0.564 . . . . 1.48 110.002 176.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.68 -47.61 80.53 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 114.626 -1.17 . . . . 2.13 109.828 -178.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.697 HD22 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -67.19 -50.27 61.6 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.853 -1.067 . . . . 0.9 110.144 -175.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.459 ' O ' ' HB2' ' A' ' 79' ' ' ASN . 59.7 tp -55.85 -52.1 65.2 Favored 'General case' 0 C--O 1.206 -1.198 0 O-C-N 123.61 0.569 . . . . 0.34 110.389 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -61.04 -37.3 82.13 Favored 'General case' 0 C--O 1.245 0.826 0 O-C-N 123.69 0.619 . . . . 0.57 112.03 -178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -61.98 -52.27 64.68 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.314 -0.403 . . . . 1.96 109.945 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 61.7 mt -70.67 -44.49 76.51 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.902 0 C-N-CA 120.223 -0.591 . . . . 0.55 109.932 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.48 ' HA ' HD11 ' A' ' 4' ' ' LEU . 6.7 t-20 -49.52 -53.59 22.62 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 123.735 0.814 . . . . 1.14 110.755 -175.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -65.25 -43.84 94.67 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.985 -0.626 . . . . 0.53 112.696 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.72 -33.94 73.18 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.12 0.486 . . . . 0.6 111.607 -177.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.414 HD23 HD12 ' A' ' 4' ' ' LEU . 26.3 tp -78.68 -31.91 46.86 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 123.835 0.854 . . . . 1.42 110.051 -178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.25 -42.02 96.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.569 0.7 . . . . 0.85 109.764 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -85.81 8.28 20.6 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.318 -0.856 . . . . 2.44 111.679 -178.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.66 116.48 24.8 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.599 -0.519 . . . . 2.12 109.599 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.295 -1.776 0 N-CA-C 107.386 -1.338 . . . . 3.84 107.386 179.12 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.1 mmm . . . . . 0 CA--C 1.51 -0.564 0 N-CA-C 108.945 -0.761 . . . . 6.63 108.945 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -155.06 -176.49 5.97 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 107.487 -1.301 . . . . 4.09 107.487 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -72.13 106.46 4.37 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-O 122.624 1.202 . . . . 2.77 109.591 174.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.501 HD11 ' HA ' ' A' ' 79' ' ' ASN . 46.4 tp -130.56 166.92 19.58 Favored 'General case' 0 N--CA 1.402 -2.848 0 CA-C-N 113.471 -1.695 . . . . 1.51 107.326 -175.314 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.405 HD11 HD22 ' A' ' 52' ' ' LEU . 96.0 mt -84.11 122.45 28.83 Favored 'General case' 0 C--N 1.289 -2.056 0 C-N-CA 120.422 -0.511 . . . . 0.8 109.8 179.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 68.4 p -102.1 -173.92 2.45 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.239 -1.393 . . . . 0.63 107.239 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.9 m -58.36 -43.3 88.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.75 -0.833 . . . . 0.61 108.75 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -60.9 -47.1 87.96 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.76 -1.109 . . . . 1.65 110.943 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.27 -39.02 89.14 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 116.091 -0.504 . . . . 1.41 110.771 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.436 HD11 HD12 ' A' ' 74' ' ' LEU . 20.0 tp -66.03 -41.59 90.7 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.79 -0.641 . . . . 0.48 110.02 -177.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -53.31 -54.73 32.19 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.878 0.871 . . . . 2.46 109.634 175.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 22.0 ttm-85 -58.72 -38.85 79.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.491 -1.231 . . . . 3.93 111.42 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -36.96 82.84 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.08 -0.509 . . . . 0.5 111.536 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.74 HD23 HG21 ' A' ' 48' ' ' THR . 94.8 mt -63.67 -44.58 93.32 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 121.219 0.533 . . . . 1.44 109.97 178.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.0 t -62.77 -50.62 79.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.395 -0.82 . . . . 0.8 109.103 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -59.72 -25.05 64.5 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.167 0.803 . . . . 2.05 113.167 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.631 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 27.5 m -90.52 -29.99 17.55 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-O 120.81 0.338 . . . . 1.39 111.721 -178.015 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.48 -32.06 54.06 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.667 -0.864 . . . . 1.58 108.667 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 115.88 -63.54 0.34 Allowed Glycine 0 CA--C 1.481 -2.093 0 N-CA-C 107.766 -2.134 . . . . 2.32 107.766 -177.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -157.75 148.29 20.85 Favored 'General case' 0 N--CA 1.417 -2.087 0 N-CA-C 106.487 -1.671 . . . . 5.17 106.487 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.3 t -155.49 -161.53 1.19 Allowed 'General case' 0 C--N 1.29 -2.008 0 N-CA-C 109.514 -0.55 . . . . 4.86 109.514 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -96.12 -53.05 3.78 Favored 'General case' 0 C--N 1.295 -1.802 0 N-CA-C 108.953 -0.758 . . . . 4.5 108.953 178.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.25 44.26 6.31 Favored Glycine 0 N--CA 1.432 -1.618 0 N-CA-C 109.448 -1.461 . . . . 2.77 109.448 -178.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 t -52.05 93.07 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.266 1.426 . . . . 2.87 113.209 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 63.51 25.54 14.47 Favored 'General case' 0 CA--C 1.501 -0.924 0 C-N-CA 124.19 0.996 . . . . 3.23 110.737 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.418 HD21 HD12 ' A' ' 14' ' ' LEU . 9.7 tp -76.78 -25.48 53.4 Favored 'General case' 0 C--O 1.248 0.987 0 CA-C-N 114.854 -1.066 . . . . 1.16 108.293 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.2 m -67.57 135.68 53.31 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 114.509 -1.223 . . . . 1.46 108.581 176.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.83 -131.85 10.75 Favored Glycine 0 N--CA 1.435 -1.377 0 N-CA-C 110.671 -0.972 . . . . 1.02 110.671 -177.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -120.06 104.98 10.58 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.85 -0.796 . . . . 2.07 108.85 -177.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.433 ' HA ' HD13 ' A' ' 33' ' ' LEU . 19.6 p90 -108.96 12.55 25.26 Favored 'General case' 0 C--N 1.298 -1.654 0 C-N-CA 120.198 -0.601 . . . . 0.44 110.734 -178.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.568 HD23 ' HB2' ' A' ' 71' ' ' PRO . 57.2 mt -51.45 -28.63 13.62 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.834 1.79 . . . . 0.39 115.834 -176.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -96.73 -6.79 35.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.489 0.661 . . . . 2.04 111.534 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 30' ' ' PHE . 8.9 mp -79.82 129.68 34.69 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 121.875 -0.516 . . . . 1.37 110.122 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.76 137.78 39.51 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 109.455 -0.572 . . . . 3.94 109.455 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -58.54 -49.72 76.38 Favored 'General case' 0 C--N 1.316 -0.869 0 O-C-N 123.69 0.619 . . . . 0.35 110.23 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -57.28 -27.37 62.06 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 123.466 0.479 . . . . 2.79 111.697 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -81.74 -32.22 31.63 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.752 0.31 . . . . 0.88 110.315 -176.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 30.5 pt -93.72 23.18 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 112.224 0.453 . . . . 0.6 112.224 -178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 78.44 14.88 81.69 Favored Glycine 0 C--O 1.24 0.507 0 C-N-CA 121.118 -0.563 . . . . 0.66 113.855 175.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -103.36 125.77 50.16 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.007 0.432 . . . . 1.33 111.097 178.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -87.46 138.48 31.44 Favored 'General case' 0 C--N 1.292 -1.9 0 N-CA-C 108.195 -1.039 . . . . 1.06 108.195 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 45.3 p -51.4 -33.09 28.74 Favored 'General case' 0 C--N 1.296 -1.743 0 O-C-N 123.718 0.636 . . . . 1.03 112.33 173.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 7.2 tt -65.77 -48.66 71.07 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.199 -0.667 . . . . 1.56 109.199 177.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.21 -34.09 76.89 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.464 0.649 . . . . 0.43 109.949 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.454 ' O ' ' HB ' ' A' ' 48' ' ' THR . 64.2 tp -63.13 -33.49 75.57 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.0 -1.0 . . . . 0.43 111.188 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 69.9 mtm -64.24 -33.81 76.66 Favored 'General case' 0 C--O 1.208 -1.103 0 C-N-CA 120.413 -0.515 . . . . 1.49 110.775 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -65.08 -34.05 77.49 Favored 'General case' 0 N--CA 1.482 1.144 0 CA-C-O 121.631 0.729 . . . . 1.88 109.556 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.74 HG21 HD23 ' A' ' 14' ' ' LEU . 37.2 m -66.21 -57.51 7.43 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.843 -1.169 . . . . 0.45 107.843 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.528 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -55.5 -36.17 66.38 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 113.963 -1.471 . . . . 0.27 109.595 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.16 -44.4 87.9 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 123.085 0.554 . . . . 0.33 112.279 178.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 38.0 mtp180 -66.19 -34.24 77.59 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.382 0.611 . . . . 2.84 109.975 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 49' ' ' ALA . 94.5 mt -65.71 -44.9 84.7 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 115.575 -0.739 . . . . 0.9 109.977 177.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.65 ' HA ' HG12 ' A' ' 58' ' ' VAL . 47.2 mt-10 -58.1 -44.17 87.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.48 109.927 174.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -61.3 -59.63 5.0 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 114.496 -1.229 . . . . 1.19 110.817 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -66.12 -41.94 89.83 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.77 1.026 . . . . 3.07 113.77 -177.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -95.26 -17.88 21.32 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 113.97 1.1 . . . . 1.01 113.97 -172.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 77.21 65.79 1.89 Allowed Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.012 -1.09 . . . . 0.93 110.858 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.65 HG12 ' HA ' ' A' ' 53' ' ' GLU . 10.6 p -140.63 176.18 5.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 107.969 -1.123 . . . . 1.16 107.969 -177.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.476 ' H ' HG22 ' A' ' 58' ' ' VAL . 22.2 p -140.96 105.47 4.87 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-O 121.594 0.711 . . . . 1.87 110.01 -178.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.407 HD12 ' HB1' ' A' ' 49' ' ' ALA . 73.7 mt -96.9 122.5 56.47 Favored Pre-proline 0 C--N 1.291 -1.955 0 CA-C-N 115.738 -0.664 . . . . 0.57 109.543 -174.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.89 128.47 26.87 Favored 'Trans proline' 0 C--O 1.238 0.503 0 C-N-CA 122.715 2.277 . . . . 0.87 111.531 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -52.97 -37.78 61.5 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.777 1.231 . . . . 1.83 111.435 -178.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -67.54 -40.98 85.02 Favored 'General case' 0 C--O 1.199 -1.565 0 CA-C-N 115.088 -0.96 . . . . 2.34 110.492 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.692 HG11 ' HG ' ' A' ' 77' ' ' LEU . 61.4 t -74.54 -45.05 46.54 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 N-CA-C 109.221 -0.659 . . . . 0.66 109.221 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.23 -36.89 66.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.539 -0.755 . . . . 0.51 111.861 -178.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -103.73 22.66 34.92 Favored Glycine 0 N--CA 1.434 -1.452 0 C-N-CA 120.302 -0.952 . . . . 0.61 112.782 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -135.03 4.66 3.26 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 121.821 0.82 . . . . 3.98 110.162 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.0 m -82.01 124.08 38.76 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.021 0 N-CA-C 109.009 -0.737 . . . . 0.44 109.009 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -88.37 -40.09 13.82 Favored 'General case' 0 CA--C 1.486 -1.485 0 C-N-CA 120.993 -0.283 . . . . 1.91 111.641 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 33.3 p -119.55 151.32 51.54 Favored Pre-proline 0 N--CA 1.417 -2.085 0 O-C-N 123.324 0.39 . . . . 0.47 110.672 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.568 ' HB2' HD23 ' A' ' 31' ' ' LEU . 68.6 Cg_exo -55.38 -32.24 80.8 Favored 'Trans proline' 0 C--O 1.206 -1.079 0 C-N-CA 123.657 2.905 . . . . 0.32 112.097 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.0 ttm105 -52.28 -48.26 65.41 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.769 0.668 . . . . 1.48 110.154 176.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -63.78 -48.9 75.09 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.95 0.9 . . . . 2.13 110.949 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.436 HD12 HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -66.48 -44.95 81.23 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.023 -0.99 . . . . 0.9 110.407 -176.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 29.7 tp -57.78 -47.22 83.18 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 123.135 0.574 . . . . 0.34 109.974 178.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.2 -47.71 80.58 Favored 'General case' 0 CA--C 1.506 -0.734 0 O-C-N 123.822 0.701 . . . . 0.57 111.689 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.692 ' HG ' HG11 ' A' ' 64' ' ' VAL . 3.4 tm? -59.66 -48.89 79.88 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 124.011 0.82 . . . . 1.96 109.872 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 47.9 mt -69.24 -39.22 78.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 116.164 -0.471 . . . . 0.55 110.541 -178.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.501 ' HA ' HD11 ' A' ' 4' ' ' LEU . 0.9 OUTLIER -60.65 -43.46 97.58 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.917 -0.129 . . . . 1.14 111.098 177.492 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.79 -42.59 98.47 Favored Glycine 0 N--CA 1.448 -0.531 0 O-C-N 123.481 0.488 . . . . 0.53 111.924 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -69.88 -42.9 72.85 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.072 0.463 . . . . 0.6 110.716 179.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.14 -14.61 62.72 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.881 0.697 . . . . 1.42 112.881 179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.66 -23.84 67.39 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.468 0.652 . . . . 0.85 109.686 173.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -91.07 4.45 52.11 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-N 115.828 -0.624 . . . . 2.44 110.757 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -95.34 142.86 27.24 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.613 -0.514 . . . . 2.12 109.613 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.623 0 N-CA-C 108.818 -0.808 . . . . 3.84 108.818 -178.783 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.5 mtm . . . . . 0 CA--C 1.503 -0.846 0 N-CA-C 109.057 -0.72 . . . . 6.63 109.057 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.15 24.58 2.13 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 109.642 -0.503 . . . . 4.09 109.642 177.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.834 ' HA ' ' HE1' ' A' ' 56' ' ' TYR . 8.5 t -122.53 103.67 8.85 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.265 1.031 . . . . 2.77 111.157 -179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 3' ' ' THR . 30.1 tp 156.55 160.37 0.01 OUTLIER 'General case' 0 N--CA 1.419 -1.995 0 C-N-CA 128.321 2.649 . . . . 1.51 105.059 172.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.458 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 88.5 mt -122.86 123.03 40.08 Favored 'General case' 0 C--N 1.284 -2.243 0 N-CA-C 108.251 -1.018 . . . . 0.8 108.251 173.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.0 p -101.54 -170.47 1.83 Allowed 'General case' 0 N--CA 1.424 -1.768 0 N-CA-C 107.841 -1.17 . . . . 0.63 107.841 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.548 HG21 ' HA ' ' A' ' 29' ' ' ASP . 3.3 m -54.58 -54.57 39.62 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 123.294 0.638 . . . . 0.61 111.407 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -73.08 -28.47 62.31 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.703 -0.399 . . . . 1.65 111.805 -176.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -66.88 -38.56 86.53 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 108.636 -0.875 . . . . 1.41 108.636 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.537 HD22 ' HB2' ' A' ' 75' ' ' LEU . 14.2 tp -66.48 -45.62 79.04 Favored 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 115.225 -0.898 . . . . 0.48 108.671 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.548 ' O ' HG23 ' A' ' 15' ' ' VAL . 2.5 tmt_? -50.62 -51.43 48.8 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.12 0.968 . . . . 2.46 109.709 175.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 27.5 ttm180 -57.72 -42.25 83.43 Favored 'General case' 0 C--N 1.313 -1.013 0 C-N-CA 124.824 1.249 . . . . 3.93 110.883 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.84 99.91 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 115.467 -0.788 . . . . 0.5 110.486 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.62 HD12 HG21 ' A' ' 48' ' ' THR . 11.1 mp -63.79 -41.64 97.88 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.98 -0.554 . . . . 1.44 111.133 177.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.548 HG23 ' O ' ' A' ' 11' ' ' ARG . 66.8 t -56.35 -55.98 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 N-CA-C 109.526 -0.546 . . . . 0.8 109.526 177.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.407 ' HB3' ' NH1' ' A' ' 51' ' ' ARG . 34.5 mm-40 -54.91 -49.11 72.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.517 -0.765 . . . . 2.05 111.968 -178.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.5 ' OG ' ' HA ' ' A' ' 48' ' ' THR . 4.0 m -77.28 -9.33 58.75 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 112.27 0.47 . . . . 1.39 112.27 -173.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -98.64 -1.63 40.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.029 0.442 . . . . 1.58 110.781 179.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 87.65 17.71 57.92 Favored Glycine 0 C--N 1.317 -0.527 0 C-N-CA 119.994 -1.098 . . . . 2.32 111.303 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.448 ' HG2' HG12 ' A' ' 15' ' ' VAL . 39.4 mt-10 60.18 67.56 0.84 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.675 1.19 . . . . 5.17 112.675 177.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -86.52 -148.78 0.14 Allowed 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 108.989 -0.745 . . . . 4.86 108.989 177.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -92.93 -35.42 13.33 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.33 -0.856 . . . . 4.5 109.104 177.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.52 4.93 65.49 Favored Glycine 0 C--O 1.219 -0.801 0 CA-C-O 119.11 -0.828 . . . . 2.77 113.959 175.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.3 t 46.48 51.04 12.19 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.568 1.147 . . . . 2.87 111.305 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.4 t70 60.57 80.19 0.22 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 113.951 -1.477 . . . . 3.23 110.087 -174.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.413 ' HG ' ' HG2' ' A' ' 11' ' ' ARG . 18.7 tp -107.79 -23.21 12.17 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 113.869 -1.514 . . . . 1.16 109.781 -173.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.5 m -59.0 125.11 22.27 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.429 -0.805 . . . . 1.46 112.521 -174.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.38 -139.89 14.74 Favored Glycine 0 N--CA 1.43 -1.712 0 CA-C-N 115.899 -0.591 . . . . 1.02 112.649 177.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.548 ' HA ' HG21 ' A' ' 7' ' ' THR . 16.3 t70 -85.45 102.52 13.53 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.15 0.5 . . . . 2.07 110.251 -178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.9 p90 -115.82 13.29 16.07 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.683 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.784 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 48.6 mt -51.66 -21.68 2.84 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.687 1.736 . . . . 0.39 115.687 -175.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -90.74 -21.63 21.47 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.181 0.515 . . . . 2.04 111.531 -179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.9 mp -77.86 117.92 19.68 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 116.079 -0.51 . . . . 1.37 110.084 -175.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -71.92 144.84 48.82 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 108.648 -0.871 . . . . 3.94 108.648 -176.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.476 ' HA ' HG12 ' A' ' 38' ' ' ILE . 66.9 m-85 -57.26 -45.69 83.76 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.37 0.508 . . . . 0.35 112.37 -175.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -60.8 -31.19 70.58 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.712 0.767 . . . . 2.79 111.37 178.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -81.54 -17.82 47.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.242 -0.89 . . . . 0.88 109.939 -175.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.476 HG12 ' HA ' ' A' ' 35' ' ' PHE . 31.1 pt -101.8 14.47 5.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.381 0.61 . . . . 0.6 111.622 173.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.4 18.71 77.62 Favored Glycine 0 CA--C 1.52 0.348 0 CA-C-N 115.636 -0.711 . . . . 0.66 114.153 175.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -98.84 128.15 44.97 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 122.422 -0.457 . . . . 1.33 111.788 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -88.72 151.05 22.66 Favored 'General case' 0 CA--C 1.491 -1.302 0 N-CA-C 107.991 -1.114 . . . . 1.06 107.991 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.552 ' O ' ' HG3' ' A' ' 46' ' ' MET . 60.7 p -53.99 -28.38 37.51 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 112.456 0.539 . . . . 1.03 112.456 175.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -62.63 -58.6 6.95 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.365 -0.606 . . . . 1.56 109.365 -179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.33 74.16 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.095 0.474 . . . . 0.43 110.577 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.493 ' O ' ' HB ' ' A' ' 48' ' ' THR . 57.6 tp -62.54 -45.18 94.14 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.523 -0.762 . . . . 0.43 110.818 179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.552 ' HG3' ' O ' ' A' ' 42' ' ' SER . 61.7 mtt -63.65 -40.71 97.55 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.6 0.238 . . . . 1.49 110.544 177.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -64.07 -29.02 70.19 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 121.767 0.794 . . . . 1.88 111.055 177.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.62 HG21 HD12 ' A' ' 14' ' ' LEU . 92.3 m -65.91 -54.8 21.71 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 107.152 -1.425 . . . . 0.45 107.152 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.523 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -57.6 -33.79 68.59 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 113.816 -1.538 . . . . 0.27 110.73 176.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.435 ' HA ' ' OE2' ' A' ' 53' ' ' GLU . . . -57.33 -46.99 82.72 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.408 0.683 . . . . 0.33 112.275 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.407 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 47.3 mtp180 -64.63 -35.54 81.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.369 0.604 . . . . 2.84 109.782 178.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 49' ' ' ALA . 83.0 mt -66.67 -43.25 85.03 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.416 -0.811 . . . . 0.9 110.221 177.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 44.5 mt-10 -55.18 -53.74 52.12 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.175 -0.676 . . . . 0.48 109.175 176.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -62.64 -42.54 99.66 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.062 -0.972 . . . . 1.19 112.609 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.06 -42.71 93.95 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.488 0.551 . . . . 3.07 112.488 -179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.834 ' HE1' ' HA ' ' A' ' 3' ' ' THR . 69.3 m-85 -96.4 -0.23 49.59 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 113.932 1.086 . . . . 1.01 113.932 -173.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 67.64 48.27 57.27 Favored Glycine 0 C--O 1.241 0.554 0 N-CA-C 111.241 -0.744 . . . . 0.93 111.241 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 59' ' ' SER . 12.7 p -139.01 176.01 6.92 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.822 0 N-CA-C 107.612 -1.255 . . . . 1.16 107.612 -177.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.412 ' H ' HG22 ' A' ' 58' ' ' VAL . 16.2 t -142.17 143.41 32.95 Favored 'General case' 0 N--CA 1.421 -1.905 0 N-CA-C 108.808 -0.812 . . . . 1.87 108.808 175.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.523 HD12 ' HB1' ' A' ' 49' ' ' ALA . 64.6 mt -121.82 123.39 27.43 Favored Pre-proline 0 C--N 1.296 -1.735 0 N-CA-C 107.417 -1.327 . . . . 0.57 107.417 -178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -61.07 138.91 81.31 Favored 'Trans proline' 0 C--O 1.254 1.278 0 C-N-CA 122.356 2.038 . . . . 0.87 111.158 177.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -53.54 -38.69 64.04 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.877 0.871 . . . . 1.83 111.296 -178.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.53 -33.88 75.96 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.407 -0.361 . . . . 2.34 111.247 -177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 81.2 t -73.1 -50.17 33.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 N-CA-C 108.083 -1.081 . . . . 0.66 108.083 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.62 -26.35 61.44 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.198 -0.91 . . . . 0.51 112.396 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -101.89 0.98 51.81 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 120.615 -0.802 . . . . 0.61 113.635 179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -98.63 -16.3 19.12 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 117.779 0.789 . . . . 3.98 110.631 -178.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.554 HG21 HD23 ' A' ' 74' ' ' LEU . 23.1 m -74.41 113.44 12.86 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-N 115.508 -0.769 . . . . 0.44 109.81 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -89.66 -39.03 13.47 Favored 'General case' 0 CA--C 1.498 -1.037 0 CA-C-N 115.553 -0.748 . . . . 1.91 111.801 -177.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 37.3 p -115.65 150.77 45.33 Favored Pre-proline 0 N--CA 1.416 -2.134 0 CA-C-N 115.675 -0.693 . . . . 0.47 109.969 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.784 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 72.2 Cg_exo -53.99 -40.45 81.03 Favored 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.623 2.882 . . . . 0.32 114.502 -178.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.46 -36.48 64.13 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.698 0.681 . . . . 1.48 111.677 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -62.6 -53.54 53.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.274 -0.639 . . . . 2.13 109.274 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.554 HD23 HG21 ' A' ' 68' ' ' VAL . 3.3 tm? -65.38 -46.43 80.12 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.9 110.051 -175.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.537 ' HB2' HD22 ' A' ' 10' ' ' LEU . 43.4 tp -58.17 -52.82 63.97 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.077 -0.51 . . . . 0.34 111.064 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.93 -39.37 93.4 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 112.012 0.375 . . . . 0.57 112.012 -176.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.21 -42.54 99.4 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.645 0.26 . . . . 1.96 111.236 176.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.26 -43.23 65.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 110.022 -0.362 . . . . 0.55 110.022 178.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -52.61 -47.23 67.1 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.713 0.405 . . . . 1.14 111.328 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -59.31 -44.19 96.73 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.628 -0.589 . . . . 0.53 111.628 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.74 -33.95 74.78 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 122.814 0.446 . . . . 0.6 111.07 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 78.6 mt -67.74 -39.36 84.25 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 122.754 0.422 . . . . 1.42 110.352 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.81 -31.62 72.93 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.755 -0.657 . . . . 0.85 110.357 176.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -75.91 -37.85 58.36 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.999 -0.546 . . . . 2.44 110.806 176.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.93 -51.62 37.99 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.918 -0.583 . . . . 2.12 111.477 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.422 0 CA-C-O 119.176 -0.44 . . . . 3.84 109.845 -177.975 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 C--O 1.24 0.563 0 CA-C-O 120.564 0.221 . . . . 6.63 110.678 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.06 79.45 5.18 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.685 0.755 . . . . 4.09 110.851 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 36.2 m -103.53 117.72 35.09 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 114.828 -1.078 . . . . 2.77 109.726 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.587 HD11 ' HB3' ' A' ' 82' ' ' LEU . 10.1 mp -79.42 154.89 28.62 Favored 'General case' 0 CA--C 1.486 -1.512 0 CA-C-O 121.538 0.685 . . . . 1.51 110.792 177.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 52' ' ' LEU . 38.9 mt -89.56 126.37 35.58 Favored 'General case' 0 C--N 1.273 -2.723 0 CA-C-N 114.385 -1.28 . . . . 0.8 109.873 -173.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 66.5 p -99.42 -170.13 1.86 Allowed 'General case' 0 N--CA 1.416 -2.148 0 N-CA-C 107.06 -1.459 . . . . 0.63 107.06 169.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.4 m -52.37 -54.21 34.81 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-N 118.399 0.545 . . . . 0.61 111.385 -178.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -64.43 -41.81 96.37 Favored 'General case' 0 C--O 1.243 0.718 0 CA-C-N 116.163 -0.471 . . . . 1.65 111.71 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -65.47 -43.5 90.07 Favored 'General case' 0 N--CA 1.483 1.215 0 CA-C-O 121.185 0.517 . . . . 1.41 110.046 -177.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.748 HD11 HD22 ' A' ' 74' ' ' LEU . 40.9 tp -65.58 -44.4 86.81 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.393 -0.821 . . . . 0.48 109.776 -178.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' O ' HG23 ' A' ' 15' ' ' VAL . 36.9 ttm105 -52.29 -44.4 65.0 Favored 'General case' 0 CA--C 1.519 -0.218 0 O-C-N 123.709 0.631 . . . . 2.46 110.93 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 75.9 ttt180 -56.37 -40.05 73.94 Favored 'General case' 0 C--O 1.208 -1.126 0 O-C-N 123.531 0.519 . . . . 3.93 111.192 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.31 -37.48 85.72 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.711 0.291 . . . . 0.5 110.524 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.559 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -66.53 -34.28 77.56 Favored 'General case' 0 C--O 1.213 -0.843 0 CA-C-N 116.192 -0.458 . . . . 1.44 110.28 175.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 11' ' ' ARG . 28.3 t -73.13 -29.79 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.415 0.626 . . . . 0.8 109.826 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 22.2 mm-40 -61.16 -53.11 61.1 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.457 -0.792 . . . . 2.05 110.168 177.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 p -75.76 -32.38 59.93 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.061 0.393 . . . . 1.39 112.061 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.57 26.7 1.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.363 0.601 . . . . 1.58 110.164 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -101.22 -8.52 47.07 Favored Glycine 0 N--CA 1.429 -1.821 0 N-CA-C 109.979 -1.248 . . . . 2.32 109.979 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -117.28 89.28 3.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 108.237 -1.023 . . . . 5.17 108.237 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 26.1 m 72.2 123.27 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.972 1.309 . . . . 4.86 110.45 -176.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 77.88 171.98 0.2 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 125.543 1.537 . . . . 4.5 110.613 -171.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.88 67.2 0.04 OUTLIER Glycine 0 CA--C 1.459 -3.463 0 C-N-CA 120.522 -0.847 . . . . 2.77 111.81 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.6 m -58.28 122.71 13.88 Favored 'General case' 0 N--CA 1.404 -2.763 0 CA-C-N 113.084 -1.558 . . . . 2.87 110.054 176.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -63.26 108.52 1.31 Allowed 'General case' 0 C--O 1.24 0.578 0 N-CA-C 108.507 -0.923 . . . . 3.23 108.507 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.6 tp -116.38 18.7 15.1 Favored 'General case' 0 C--N 1.297 -1.699 0 CA-C-N 115.359 -0.837 . . . . 1.16 110.572 -170.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.405 ' HA ' ' HD3' ' A' ' 11' ' ' ARG . 13.0 p -62.61 137.87 58.36 Favored 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 115.362 -0.835 . . . . 1.46 111.954 -178.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.95 -157.97 19.63 Favored Glycine 0 N--CA 1.435 -1.39 0 CA-C-N 115.72 -0.673 . . . . 1.02 112.795 178.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -87.98 104.88 17.05 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 123.261 0.624 . . . . 2.07 110.003 -179.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.401 ' O ' ' HG2' ' A' ' 71' ' ' PRO . 10.2 p90 -113.23 13.08 19.13 Favored 'General case' 0 C--N 1.308 -1.229 0 CA-C-N 115.785 -0.643 . . . . 0.44 111.207 -175.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.678 ' HA ' ' HB2' ' A' ' 71' ' ' PRO . 38.5 mt -52.11 -25.23 8.34 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.608 1.707 . . . . 0.39 115.608 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -100.24 -10.26 21.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.351 0.596 . . . . 2.04 111.121 -178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 88.9 mt -79.97 119.79 23.29 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.805 -0.443 . . . . 1.37 109.805 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.89 151.1 38.97 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.161 -0.472 . . . . 3.94 109.862 -175.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.633 ' HA ' HG12 ' A' ' 38' ' ' ILE . 68.9 m-85 -68.53 -37.07 79.68 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 116.305 -0.407 . . . . 0.35 110.585 -176.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -57.85 -29.26 64.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.165 0.507 . . . . 2.79 110.969 175.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -83.11 -31.46 27.24 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.711 -0.677 . . . . 0.88 111.22 -178.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.633 HG12 ' HA ' ' A' ' 35' ' ' PHE . 34.9 pt -93.84 24.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.185 0.517 . . . . 0.6 111.922 -179.132 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 36.24 91.03 Favored Glycine 0 N--CA 1.453 -0.183 0 CA-C-N 115.292 -0.867 . . . . 0.66 113.582 176.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.53 122.17 45.74 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-O 121.182 0.515 . . . . 1.33 112.129 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.72 148.72 24.62 Favored 'General case' 0 CA--C 1.485 -1.552 0 N-CA-C 107.821 -1.177 . . . . 1.06 107.821 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.442 ' O ' ' HG3' ' A' ' 46' ' ' MET . 31.1 p -54.75 -33.99 61.96 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 113.556 0.946 . . . . 1.03 113.556 179.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.8 tt -66.38 -45.24 80.74 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.066 -0.716 . . . . 1.56 109.066 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.41 87.49 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.099 -0.501 . . . . 0.43 110.043 176.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.404 HD21 HG23 ' A' ' 68' ' ' VAL . 55.6 tp -62.9 -39.36 94.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.273 -0.876 . . . . 0.43 111.185 178.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 42' ' ' SER . 65.5 mtm -64.08 -31.27 72.4 Favored 'General case' 0 C--O 1.199 -1.596 0 C-N-CA 120.66 -0.416 . . . . 1.49 110.969 177.199 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.55 -34.28 77.87 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-O 121.521 0.677 . . . . 1.88 110.191 178.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.559 HG21 HD13 ' A' ' 14' ' ' LEU . 35.8 m -64.12 -59.47 4.4 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 106.859 -1.534 . . . . 0.45 106.859 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -56.31 -38.08 70.78 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-N 114.05 -1.432 . . . . 0.27 110.16 176.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -57.72 -48.0 80.84 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 123.242 0.617 . . . . 0.33 112.533 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -64.45 -36.39 84.0 Favored 'General case' 0 C--O 1.226 -0.171 0 N-CA-C 109.618 -0.512 . . . . 2.84 109.618 179.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.524 HD22 HD11 ' A' ' 5' ' ' LEU . 83.8 mt -64.97 -45.4 85.83 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.75 -0.659 . . . . 0.9 111.181 176.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 43.9 mt-10 -56.27 -50.53 71.11 Favored 'General case' 0 CA--C 1.499 -1.012 0 C-N-CA 122.845 0.458 . . . . 0.48 109.881 176.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.8 t -61.82 -43.21 99.31 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 114.68 -1.146 . . . . 1.19 110.095 -177.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.472 ' HD2' ' CE2' ' A' ' 56' ' ' TYR . 31.3 ttm180 -65.94 -52.39 50.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.334 -0.394 . . . . 3.07 111.902 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.472 ' CE2' ' HD2' ' A' ' 55' ' ' ARG . 85.3 m-85 -92.97 -17.55 23.79 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.376 1.251 . . . . 1.01 114.376 -170.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.8 53.11 4.71 Favored Glycine 0 C--N 1.312 -0.75 0 C-N-CA 119.99 -1.1 . . . . 0.93 110.762 -179.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.09 140.66 43.47 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 N-CA-C 108.544 -0.909 . . . . 1.16 108.544 -177.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.4 p -93.78 115.13 27.52 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 112.194 0.442 . . . . 1.87 112.194 -179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 69.2 mt -104.42 118.05 57.65 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.553 -0.906 . . . . 0.57 108.553 176.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -57.53 123.35 13.57 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.594 2.196 . . . . 0.87 111.313 178.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -50.38 -47.82 56.11 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.488 1.115 . . . . 1.83 113.692 -174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -70.31 -32.69 70.55 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 120.885 0.374 . . . . 2.34 110.641 -176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 61.8 t -73.26 -41.11 57.98 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 N-CA-C 108.584 -0.895 . . . . 0.66 108.584 179.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.28 -33.96 68.17 Favored 'General case' 0 C--O 1.214 -0.78 0 C-N-CA 123.712 0.805 . . . . 0.51 111.589 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -90.41 -17.01 54.32 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.434 -0.889 . . . . 0.61 112.76 179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -101.57 7.36 42.28 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 113.587 0.958 . . . . 3.98 113.587 -177.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.404 HG23 HD21 ' A' ' 45' ' ' LEU . 12.7 m -77.3 114.22 17.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 106.904 -1.517 . . . . 0.44 106.904 171.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -90.36 -34.69 15.59 Favored 'General case' 0 CA--C 1.491 -1.301 0 CA-C-O 121.619 0.723 . . . . 1.91 110.527 -173.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.406 ' HA ' ' HD3' ' A' ' 71' ' ' PRO . 67.9 p -117.42 142.52 30.45 Favored Pre-proline 0 N--CA 1.411 -2.423 0 CA-C-N 115.343 -0.844 . . . . 0.47 109.961 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.678 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 76.9 Cg_exo -55.5 -28.9 66.72 Favored 'Trans proline' 0 CA--C 1.499 -1.24 0 C-N-CA 123.866 3.044 . . . . 0.32 111.946 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 44.8 ttm180 -50.3 -51.71 42.85 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 124.425 1.078 . . . . 1.48 109.668 174.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -65.67 -42.48 91.26 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 115.101 -0.954 . . . . 2.13 111.249 -178.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.748 HD22 HD11 ' A' ' 10' ' ' LEU . 5.0 tt -66.49 -44.07 83.61 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 108.964 -0.754 . . . . 0.9 108.964 -177.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 31.7 tp -56.98 -51.86 67.54 Favored 'General case' 0 C--O 1.245 0.854 0 C-N-CA 123.525 0.73 . . . . 0.34 109.226 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.35 -44.07 92.72 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.813 -1.085 . . . . 0.57 111.407 179.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.7 tp -57.85 -50.06 74.59 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.751 0.82 . . . . 1.96 111.341 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 41.7 mt -70.55 -40.29 77.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 C-N-CA 120.393 -0.523 . . . . 0.55 110.724 -178.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.432 ' OD1' HD23 ' A' ' 4' ' ' LEU . 13.8 m-80 -60.99 -39.63 90.4 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 120.48 0.181 . . . . 1.14 110.745 177.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -70.85 -39.78 64.67 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.314 -0.469 . . . . 0.53 112.445 178.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.65 -45.03 65.91 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.838 0.352 . . . . 0.6 110.936 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.587 ' HB3' HD11 ' A' ' 4' ' ' LEU . 21.5 mt -69.36 -15.5 63.33 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.402 0.681 . . . . 1.42 112.486 179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.67 -32.2 73.76 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-O 121.526 0.679 . . . . 0.85 109.182 173.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -93.34 -67.08 0.88 Allowed 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.432 -0.804 . . . . 2.44 109.605 177.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -73.06 104.03 4.01 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 115.258 -0.883 . . . . 2.12 112.011 -173.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.84 0 N-CA-C 107.113 -1.439 . . . . 3.84 107.113 179.567 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 mmt . . . . . 0 N--CA 1.47 0.568 0 CA-C-O 120.888 0.375 . . . . 6.63 111.128 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.63 25.65 6.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.644 0.735 . . . . 4.09 109.69 -176.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.476 HG23 ' CD1' ' A' ' 56' ' ' TYR . 52.0 m -87.8 105.49 17.44 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-O 122.033 0.921 . . . . 2.77 111.865 -177.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 5' ' ' LEU . 28.9 tp 175.25 156.15 0.17 Allowed 'General case' 0 N--CA 1.405 -2.709 0 CA-C-N 113.084 -1.871 . . . . 1.51 106.227 172.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.441 ' N ' ' HG ' ' A' ' 4' ' ' LEU . 85.9 mt -120.14 123.67 43.9 Favored 'General case' 0 N--CA 1.406 -2.665 0 N-CA-C 108.273 -1.01 . . . . 0.8 108.273 176.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 73.7 p -98.37 -179.87 4.49 Favored 'General case' 0 C--N 1.296 -1.741 0 N-CA-C 106.585 -1.635 . . . . 0.63 106.585 172.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.783 HG21 ' HA ' ' A' ' 29' ' ' ASP . 20.6 m -59.47 -31.93 69.78 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 118.638 0.654 . . . . 0.61 110.505 175.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.24 -46.72 63.89 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.44 -0.578 . . . . 1.65 109.44 -179.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -64.51 -39.54 93.96 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.589 -0.732 . . . . 1.41 109.527 179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.554 HD11 HD12 ' A' ' 74' ' ' LEU . 15.0 tp -65.49 -51.38 60.48 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 114.893 -1.048 . . . . 0.48 109.195 -177.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.3 ttp-105 -52.32 -40.65 62.15 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.312 0.645 . . . . 2.46 111.766 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.535 ' O ' ' HG3' ' A' ' 16' ' ' GLU . 60.6 ttt180 -54.3 -54.52 39.09 Favored 'General case' 0 C--O 1.24 0.577 0 O-C-N 123.549 0.531 . . . . 3.93 110.586 176.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.46 -39.13 89.76 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.536 -0.756 . . . . 0.5 111.547 -175.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.8 -50.99 68.84 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.162 0.288 . . . . 1.44 111.174 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.8 t -63.52 -34.72 69.27 Favored 'Isoleucine or valine' 0 C--O 1.246 0.871 0 CA-C-O 120.999 0.428 . . . . 0.8 111.46 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 12' ' ' ARG . 95.6 mt-10 -63.22 -49.31 74.68 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.245 0.545 . . . . 2.05 111.218 177.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.5 p -82.23 -8.13 59.64 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.473 -0.785 . . . . 1.39 112.889 -174.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.0 -26.85 68.75 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.581 0.705 . . . . 1.58 110.26 177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 83.22 -52.97 4.81 Favored Glycine 0 N--CA 1.438 -1.177 0 N-CA-C 109.749 -1.34 . . . . 2.32 109.749 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -62.06 109.18 1.21 Allowed 'General case' 0 C--N 1.31 -1.112 0 C-N-CA 124.253 1.021 . . . . 5.17 108.75 178.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 17.9 m -113.77 27.39 9.58 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 122.538 1.161 . . . . 4.86 109.391 -177.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -74.39 -64.09 1.1 Allowed 'General case' 0 CA--C 1.492 -1.263 0 N-CA-C 106.666 -1.605 . . . . 4.5 106.666 174.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 157.78 67.49 0.01 OUTLIER Glycine 0 N--CA 1.409 -3.11 0 C-N-CA 119.604 -1.284 . . . . 2.77 113.618 176.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 t -79.74 73.01 6.47 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 107.566 -1.272 . . . . 2.87 107.566 170.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -57.89 125.28 22.37 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-N 115.027 -0.988 . . . . 3.23 111.434 -174.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.9 tp -132.87 26.31 4.3 Favored 'General case' 0 C--N 1.282 -2.344 0 N-CA-C 107.059 -1.46 . . . . 1.16 107.059 -171.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 56.3 p -53.6 134.46 41.23 Favored 'General case' 0 C--O 1.249 1.056 0 CA-C-N 114.401 -1.272 . . . . 1.46 112.799 -174.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.32 -161.52 27.67 Favored Glycine 0 N--CA 1.43 -1.734 0 CA-C-N 114.842 -1.072 . . . . 1.02 110.969 177.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.783 ' HA ' HG21 ' A' ' 7' ' ' THR . 10.2 m-20 -77.7 126.33 30.7 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 109.064 -0.717 . . . . 2.07 109.064 177.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.411 ' HB2' HD12 ' A' ' 33' ' ' LEU . 23.6 p90 -123.32 19.08 9.8 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.943 -0.762 . . . . 0.44 108.943 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.687 HD13 ' HB3' ' A' ' 72' ' ' ARG . 29.3 mt -53.63 -23.19 10.39 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 114.58 1.326 . . . . 0.39 114.58 -175.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -92.0 -22.53 19.93 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.894 0.378 . . . . 2.04 110.475 -176.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.411 HD12 ' HB2' ' A' ' 30' ' ' PHE . 66.3 mt -77.59 114.09 16.08 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.824 -1.176 . . . . 1.37 107.824 -178.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -75.72 146.74 39.87 Favored 'General case' 0 N--CA 1.435 -1.179 0 C-N-CA 120.128 -0.629 . . . . 3.94 109.631 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.568 ' HB3' ' HB2' ' A' ' 40' ' ' TYR . 55.5 m-85 -55.22 -40.88 71.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.993 -0.549 . . . . 0.35 111.424 -175.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.06 -34.78 63.87 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.814 -0.63 . . . . 2.79 111.724 178.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.2 -34.23 32.42 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 116.143 -0.481 . . . . 0.88 110.259 -174.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 pt -90.8 17.7 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 N-CA-C 113.118 0.784 . . . . 0.6 113.118 -178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 85.81 14.47 67.47 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 114.564 0.586 . . . . 0.66 114.564 172.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.568 ' HB2' ' HB3' ' A' ' 35' ' ' PHE . 32.6 m-85 -101.33 115.17 29.88 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-O 120.796 0.331 . . . . 1.33 111.418 -179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -87.22 154.54 20.63 Favored 'General case' 0 C--N 1.29 -1.985 0 N-CA-C 106.427 -1.694 . . . . 1.06 106.427 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.554 ' O ' ' HG3' ' A' ' 46' ' ' MET . 44.1 p -51.44 -27.88 11.46 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 113.509 0.929 . . . . 1.03 113.509 177.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -64.35 -57.76 8.44 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 109.162 -0.681 . . . . 1.56 109.162 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.44 -35.68 78.25 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.23 0.538 . . . . 0.43 110.391 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 57.8 tp -62.69 -33.6 75.4 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.121 -0.945 . . . . 0.43 110.95 179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.554 ' HG3' ' O ' ' A' ' 42' ' ' SER . 69.3 mtm -65.81 -29.76 70.29 Favored 'General case' 0 C--O 1.199 -1.559 0 C-N-CA 120.164 -0.615 . . . . 1.49 112.084 176.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 36.2 tt0 -65.79 -29.12 69.56 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-O 121.803 0.811 . . . . 1.88 109.505 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 52' ' ' LEU . 24.6 m -64.62 -58.01 7.5 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 106.193 -1.78 . . . . 0.45 106.193 179.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 53' ' ' GLU . . . -57.33 -38.44 74.11 Favored 'General case' 0 C--O 1.2 -1.523 0 CA-C-N 113.875 -1.512 . . . . 0.27 110.759 176.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.66 -45.31 81.74 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.531 0.732 . . . . 0.33 112.348 -179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.522 ' NH1' ' HB3' ' A' ' 16' ' ' GLU . 50.6 mtt180 -64.83 -38.63 91.61 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.744 -0.662 . . . . 2.84 109.572 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 48' ' ' THR . 86.7 mt -65.71 -41.39 92.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.055 -0.975 . . . . 0.9 110.271 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 37.7 mt-10 -57.0 -54.85 42.11 Favored 'General case' 0 CA--C 1.502 -0.885 0 O-C-N 123.624 0.577 . . . . 0.48 109.813 175.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.3 t -62.33 -38.5 89.7 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.501 -0.772 . . . . 1.19 111.928 -177.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -68.1 -51.02 51.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.693 0.627 . . . . 3.07 112.693 177.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.476 ' CD1' HG23 ' A' ' 3' ' ' THR . 65.0 m-85 -93.77 -12.38 29.25 Favored 'General case' 0 C--N 1.311 -1.1 0 N-CA-C 113.749 1.018 . . . . 1.01 113.749 -171.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 76.63 17.94 79.45 Favored Glycine 0 C--N 1.308 -1.006 0 C-N-CA 120.698 -0.763 . . . . 0.93 111.285 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.474 HG12 ' HB2' ' A' ' 56' ' ' TYR . 7.5 p -98.38 135.06 34.59 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 N-CA-C 107.948 -1.13 . . . . 1.16 107.948 -178.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.7 m -92.87 118.45 31.14 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.997 -0.742 . . . . 1.87 108.997 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.1 mt -103.29 117.55 59.96 Favored Pre-proline 0 C--N 1.301 -1.521 0 N-CA-C 108.548 -0.908 . . . . 0.57 108.548 -178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -56.34 128.19 29.1 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.839 2.359 . . . . 0.87 110.977 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -51.28 -38.75 54.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.363 1.065 . . . . 1.83 111.943 -177.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.68 -45.31 79.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 CA-C-N 115.901 -0.591 . . . . 2.34 110.652 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 67.1 t -71.99 -36.06 56.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 O-C-N 123.428 0.455 . . . . 0.66 109.879 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.48 -32.17 64.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 115.475 -0.784 . . . . 0.51 111.365 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 42' ' ' SER . . . -116.98 23.13 10.15 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.5 -0.857 . . . . 0.61 112.297 178.097 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -101.15 -22.16 14.76 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.45 0.643 . . . . 3.98 110.334 -178.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.509 HG21 ' HB2' ' A' ' 74' ' ' LEU . 17.8 m -76.19 130.8 35.89 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.81 0 CA-C-N 114.984 -1.007 . . . . 0.44 111.594 -175.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.43 -50.09 6.78 Favored 'General case' 0 CA--C 1.481 -1.689 0 CA-C-N 115.706 -0.679 . . . . 1.91 111.343 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 32.2 p -109.13 149.23 39.4 Favored Pre-proline 0 N--CA 1.405 -2.701 0 CA-C-N 115.846 -0.615 . . . . 0.47 110.479 -177.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.494 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 89.3 Cg_exo -51.82 -38.81 68.32 Favored 'Trans proline' 0 C--O 1.211 -0.831 0 C-N-CA 123.269 2.646 . . . . 0.32 112.228 177.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.687 ' HB3' HD13 ' A' ' 31' ' ' LEU . 13.6 ptt180 -55.63 -35.17 65.6 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 113.676 0.991 . . . . 1.48 113.676 176.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -63.78 -50.62 68.29 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.791 0.805 . . . . 2.13 109.137 176.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.554 HD12 HD11 ' A' ' 10' ' ' LEU . 3.4 tm? -66.57 -47.22 73.47 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.319 -1.31 . . . . 0.9 109.906 -176.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.415 HD13 HD22 ' A' ' 10' ' ' LEU . 51.4 tp -56.78 -48.77 77.12 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.646 0.778 . . . . 0.34 110.735 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.68 -44.05 82.82 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 116.346 -0.388 . . . . 0.57 111.52 -177.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.11 -47.94 83.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.004 -0.544 . . . . 1.96 109.565 -179.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 59.5 mt -72.15 -35.21 52.44 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.169 0 C-N-CA 120.158 -0.617 . . . . 0.55 111.439 -179.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.1 -44.02 82.8 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-N 117.969 0.35 . . . . 1.14 110.8 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.18 -43.33 98.77 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.541 -0.624 . . . . 0.53 111.541 177.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.58 -25.77 65.06 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 120.974 0.416 . . . . 0.6 111.271 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 78' ' ' ILE . 66.6 mt -79.58 -40.66 28.9 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 116.207 -0.451 . . . . 1.42 110.513 177.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.89 -34.2 76.91 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.439 0.638 . . . . 0.85 110.174 177.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -86.04 3.47 42.2 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.457 -0.792 . . . . 2.44 112.277 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -91.17 90.71 7.91 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-O 120.825 0.345 . . . . 2.12 110.709 -179.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.369 0 N-CA-C 107.579 -1.267 . . . . 3.84 107.579 -178.485 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 N--CA 1.47 0.526 0 N-CA-C 110.457 -0.201 . . . . 6.63 110.457 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 67.49 34.58 4.6 Favored 'General case' 0 C--N 1.346 0.435 0 C-N-CA 123.966 0.906 . . . . 4.09 111.1 176.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 8.1 t -81.34 106.97 13.73 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.305 -1.368 . . . . 2.77 107.305 176.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.404 ' HA ' HD13 ' A' ' 82' ' ' LEU . 11.5 tp -68.59 154.27 42.21 Favored 'General case' 0 N--CA 1.407 -2.6 0 CA-C-N 113.154 -1.839 . . . . 1.51 112.498 -172.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.428 HD21 ' CZ ' ' A' ' 56' ' ' TYR . 96.4 mt -101.66 131.34 47.94 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 114.419 -1.264 . . . . 0.8 108.941 176.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 63.8 p -102.22 -176.44 3.12 Favored 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 106.963 -1.495 . . . . 0.63 106.963 170.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.766 HG21 ' HA ' ' A' ' 29' ' ' ASP . 27.0 m -58.14 -39.7 79.44 Favored 'General case' 0 CA--C 1.555 1.136 0 CA-C-N 118.284 0.493 . . . . 0.61 111.371 177.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -64.84 -42.53 94.84 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.104 0.478 . . . . 1.65 110.05 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -67.89 -41.19 83.14 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.685 -0.689 . . . . 1.41 109.601 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.428 HD11 ' CD1' ' A' ' 74' ' ' LEU . 28.0 tp -64.82 -43.82 91.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.762 -1.108 . . . . 0.48 110.539 -176.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 26' ' ' LEU . 40.3 ttp180 -49.93 -41.74 46.92 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.471 0.708 . . . . 2.46 111.92 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.418 ' HG2' ' OE2' ' A' ' 16' ' ' GLU . 40.6 ttm180 -55.47 -43.76 75.8 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.915 0.76 . . . . 3.93 111.116 -177.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.465 ' HB2' HD21 ' A' ' 52' ' ' LEU . . . -63.68 -42.08 98.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.239 -0.437 . . . . 0.5 110.839 -178.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.648 HD13 HG21 ' A' ' 48' ' ' THR . 3.8 mm? -64.83 -37.06 86.34 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.358 -0.383 . . . . 1.44 110.519 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 89.6 t -67.64 -53.31 32.41 Favored 'Isoleucine or valine' 0 C--O 1.244 0.801 0 N-CA-C 109.937 -0.394 . . . . 0.8 109.937 177.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.418 ' OE2' ' HG2' ' A' ' 12' ' ' ARG . 42.9 mt-10 -58.97 -40.6 85.26 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.902 -0.59 . . . . 2.05 112.503 -177.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.9 p -77.01 -15.29 59.67 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 119.998 -0.681 . . . . 1.39 112.465 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.86 -58.03 3.27 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.845 -0.798 . . . . 1.58 108.845 177.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.59 56.11 23.34 Favored Glycine 0 N--CA 1.441 -1.026 0 CA-C-N 115.627 -0.715 . . . . 2.32 111.906 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -126.19 160.85 29.11 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 109.607 -0.516 . . . . 5.17 109.607 177.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.3 m -86.11 33.37 0.61 Allowed 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 121.515 0.674 . . . . 4.86 112.277 -172.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -146.69 136.24 22.98 Favored 'General case' 0 C--N 1.294 -1.819 0 O-C-N 121.893 -0.505 . . . . 4.5 109.883 177.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -93.61 87.95 1.2 Allowed Glycine 0 N--CA 1.418 -2.537 0 N-CA-C 108.5 -1.84 . . . . 2.77 108.5 176.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.532 HG23 HD13 ' A' ' 26' ' ' LEU . 6.8 t -61.47 179.07 0.25 Allowed 'General case' 0 CA--C 1.573 1.836 0 C-N-CA 123.381 0.672 . . . . 2.87 112.629 -177.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -78.46 80.3 4.86 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.24 0.83 . . . . 3.23 113.24 -172.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.541 ' O ' ' HD3' ' A' ' 11' ' ' ARG . 9.5 mp -121.45 8.64 10.19 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.432 -1.258 . . . . 1.16 108.038 174.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.2 m -66.57 138.86 57.78 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 114.19 -1.368 . . . . 1.46 109.986 -178.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.54 -124.16 12.44 Favored Glycine 0 N--CA 1.439 -1.113 0 N-CA-C 110.263 -1.135 . . . . 1.02 110.263 -177.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.766 ' HA ' HG21 ' A' ' 7' ' ' THR . 6.6 p-10 -115.28 122.37 45.75 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 108.591 -0.892 . . . . 2.07 108.591 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.32 19.49 15.51 Favored 'General case' 0 C--N 1.302 -1.478 0 CA-C-O 121.49 0.662 . . . . 0.44 109.518 -178.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.64 ' O ' ' HB ' ' A' ' 70' ' ' THR . 59.5 mt -51.98 -32.08 32.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 114.716 1.376 . . . . 0.39 114.716 -177.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -94.73 -1.88 52.15 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.101 0.477 . . . . 2.04 112.007 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.5 mp -81.34 129.52 34.66 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.722 -0.844 . . . . 1.37 108.722 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.03 142.61 43.77 Favored 'General case' 0 C--N 1.291 -1.937 0 N-CA-C 108.033 -1.099 . . . . 3.94 108.033 -177.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.525 ' HA ' HG12 ' A' ' 38' ' ' ILE . 73.2 m-85 -60.13 -41.8 93.45 Favored 'General case' 0 C--O 1.216 -0.694 0 C-N-CA 120.546 -0.462 . . . . 0.35 109.8 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -57.25 -27.02 61.7 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.039 -0.528 . . . . 2.79 112.101 177.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.19 -34.47 37.39 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 108.651 -0.87 . . . . 0.88 108.651 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.525 HG12 ' HA ' ' A' ' 35' ' ' PHE . 32.8 pt -91.64 16.95 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.049 0.452 . . . . 0.6 110.803 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.84 55.77 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-N 115.55 -0.75 . . . . 0.66 113.701 176.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -118.09 108.93 15.82 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 113.156 0.798 . . . . 1.33 113.156 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -85.35 147.45 26.52 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 106.924 -1.51 . . . . 1.06 106.924 174.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.521 ' O ' ' HG3' ' A' ' 46' ' ' MET . 18.0 p -50.87 -31.04 16.14 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 114.237 1.199 . . . . 1.03 114.237 -178.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.77 -53.94 43.06 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.226 -1.028 . . . . 1.56 108.226 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.51 -35.24 79.83 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-O 121.29 0.567 . . . . 0.43 110.32 178.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.497 ' HB3' ' HA ' ' A' ' 42' ' ' SER . 59.8 tp -61.57 -37.71 84.84 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.352 -0.84 . . . . 0.43 111.615 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.521 ' HG3' ' O ' ' A' ' 42' ' ' SER . 59.9 mtm -63.78 -33.4 75.57 Favored 'General case' 0 C--O 1.207 -1.134 0 C-N-CA 120.735 -0.386 . . . . 1.49 110.657 177.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -66.78 -32.18 73.3 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 121.946 0.879 . . . . 1.88 109.805 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.648 HG21 HD13 ' A' ' 14' ' ' LEU . 55.6 m -66.52 -55.86 13.57 Favored 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 107.411 -1.329 . . . . 0.45 107.411 178.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.511 ' HB1' HD12 ' A' ' 60' ' ' ILE . . . -55.92 -38.21 69.97 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 113.72 -1.582 . . . . 0.27 109.855 177.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.8 -42.85 80.26 Favored 'General case' 0 C--O 1.251 1.17 0 C-N-CA 123.099 0.56 . . . . 0.33 112.45 179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 19.6 mtp180 -66.31 -38.72 88.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 115.967 -0.561 . . . . 2.84 109.724 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 13' ' ' ALA . 85.4 mt -63.98 -45.68 87.98 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.422 -0.808 . . . . 0.9 110.498 177.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 49' ' ' ALA . 45.8 mt-10 -56.53 -49.6 74.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.83 -0.623 . . . . 0.48 110.084 176.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.2 t -62.37 -54.73 36.17 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.983 -1.008 . . . . 1.19 110.894 -177.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 43.1 ttm180 -64.91 -38.13 89.94 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 113.375 0.879 . . . . 3.07 113.375 -174.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.428 ' CZ ' HD21 ' A' ' 5' ' ' LEU . 99.4 m-85 -98.7 -9.52 24.5 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 114.504 1.298 . . . . 1.01 114.504 -173.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.42 50.58 8.11 Favored Glycine 0 C--N 1.316 -0.557 0 C-N-CA 120.278 -0.963 . . . . 0.93 111.792 178.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.3 p -142.61 175.48 4.42 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 N-CA-C 106.96 -1.496 . . . . 1.16 106.96 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 9.6 t -142.22 139.34 31.97 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 119.19 0.905 . . . . 1.87 109.802 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.511 HD12 ' HB1' ' A' ' 49' ' ' ALA . 70.5 mt -114.1 129.46 24.79 Favored Pre-proline 0 C--N 1.298 -1.667 0 N-CA-C 108.043 -1.095 . . . . 0.57 108.043 -177.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -62.73 113.98 2.21 Favored 'Trans proline' 0 C--O 1.245 0.844 0 C-N-CA 122.005 1.803 . . . . 0.87 109.742 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -55.49 -29.72 59.3 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.612 0.765 . . . . 1.83 113.004 -176.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -68.63 -41.03 80.02 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 109.823 -0.436 . . . . 2.34 109.823 178.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 45.2 t -75.17 -34.79 32.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.163 -0.68 . . . . 0.66 109.163 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.08 65.54 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.694 -0.685 . . . . 0.51 110.99 176.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -91.8 -3.74 68.1 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.591 -0.814 . . . . 0.61 112.76 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 -101.37 -14.45 17.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-O 121.333 0.587 . . . . 3.98 110.829 -177.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.4 m -76.17 124.25 33.96 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.332 0 CA-C-O 121.047 0.451 . . . . 0.44 109.904 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -92.29 -33.18 14.73 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 115.915 -0.584 . . . . 1.91 111.712 -175.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.64 ' HB ' ' O ' ' A' ' 31' ' ' LEU . 40.2 p -125.63 152.25 71.75 Favored Pre-proline 0 N--CA 1.418 -2.037 0 CA-C-N 115.645 -0.707 . . . . 0.47 110.085 -177.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.588 ' HB2' HD23 ' A' ' 31' ' ' LEU . 54.2 Cg_exo -56.37 -26.3 61.73 Favored 'Trans proline' 0 C--O 1.2 -1.409 0 C-N-CA 123.57 2.846 . . . . 0.32 111.109 176.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -51.22 -57.21 9.4 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.84 0.856 . . . . 1.48 109.961 174.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -64.32 -41.11 96.99 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.463 -0.789 . . . . 2.13 110.885 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.428 ' CD1' HD11 ' A' ' 10' ' ' LEU . 3.3 tm? -67.54 -46.17 73.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.47 -0.786 . . . . 0.9 110.691 -177.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 44.6 tp -57.6 -52.16 66.56 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.007 -0.738 . . . . 0.34 109.007 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -52.39 -44.6 65.43 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 124.811 1.244 . . . . 0.57 111.414 177.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 67.9 tp -62.38 -51.3 68.11 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 123.732 0.813 . . . . 1.96 111.197 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 74' ' ' LEU . 58.8 mt -66.33 -39.75 84.98 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 CA-C-N 116.165 -0.47 . . . . 0.55 110.119 -178.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.95 -43.8 86.58 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 116.411 -0.359 . . . . 1.14 110.121 176.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.468 ' O ' ' HG3' ' A' ' 84' ' ' GLU . . . -64.23 -42.7 97.8 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.575 -0.739 . . . . 0.53 112.003 178.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.84 79.91 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.757 0.313 . . . . 0.6 110.746 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 4' ' ' LEU . 71.0 mt -65.58 -36.65 84.39 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 122.647 0.379 . . . . 1.42 110.978 176.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.83 -34.65 78.88 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.069 -0.514 . . . . 0.85 110.6 176.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 80' ' ' GLY . 42.1 mt-10 -75.39 -32.79 60.89 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.299 -0.41 . . . . 2.44 110.499 178.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -66.84 106.52 1.91 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.308 0.575 . . . . 2.12 110.982 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.439 0 CA-C-N 115.306 -0.861 . . . . 3.84 108.821 178.84 . . . . . . . . 0 0 . 1 stop_ save_